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| first_mask_gen_count
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| first_mask_gen_count_real
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<|startoftext|><L>CS(=O)(=O)N[C@@H<mask_1:5>O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:5> | 6 | 16 | 5 | ](CC(= | 5 | CS(=O)(=O)N[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | ](C(= |
<|startoftext|><L>CS(=O)(=O<mask_1:6>](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:6> | 7 | 9 | 6 | )N[C@@H | 6 | CS(=O)(=O)N[C@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | )N[C@H |
<|startoftext|><L>CS(=O)(=<mask_1:4>N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:4> | 2 | 8 | 4 | O) | 4 | CS(=O)(=O)CCN[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | O)CC |
<|startoftext|><L>CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1cc<mask_1:5>F)cc1<mask_1:5> | 2 | 44 | 5 | c( | 5 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(OCCF)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | c(OCC |
<|startoftext|><L>CS(=O)(=O)N[C@@H]<mask_1:5>(CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:5> | 0 | 17 | 5 | 5 | CS(=O)(=O)N[C@@H](CO)N(CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | (CO)N |
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<|startoftext|><L><mask_1:3>O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:3> | 4 | 0 | 3 | CS(= | 3 | S(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | S(= |
<|startoftext|><L><mask_1:6>(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:6> | 2 | 0 | 6 | CS | 6 | CN(C)S(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CN(C)S |
<|startoftext|><L>CS(=O)(=O)N[C@@H](C<mask_1:4>c1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:4> | 6 | 19 | 4 | C(=O)N | 4 | CS(=O)(=O)N[C@@H](C(=O)c1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | (=O) |
<|startoftext|><L>CS(=O)(=O)N[C@@H](CC(=O)Nc1c<mask_1:7>)cc1Cl)c1ccc(F)cc1<mask_1:7> | 5 | 28 | 7 | cc(Cl | 6 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | cc(C#N |
<|startoftext|><L><mask_1:3>(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1<mask_1:3> | 2 | 0 | 3 | CS | 3 | CCS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CS(=O)(=O)N[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)c1ccc(F)cc1 | CCS |
<|startoftext|><L>O=C<mask_1:4>(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1<mask_1:4> | 0 | 3 | 4 | 4 | O=C(O)C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | (O)C |
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<|startoftext|><L>O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO<mask_1:1>)Cc1ccc(F)cc1<mask_1:1> | 0 | 38 | 1 | 1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](COO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O |
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<|startoftext|><L>O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)<mask_1:7>(F)cc1<mask_1:7> | 6 | 39 | 7 | Cc1ccc | 7 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)COc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | COc1ccc |
<|startoftext|><L>O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(<mask_1:2>1<mask_1:2> | 4 | 46 | 2 | F)cc | 2 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(O)1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O) |
<|startoftext|><L>O=C(N<mask_1:3>(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1<mask_1:3> | 5 | 5 | 3 | =c1nc | 3 | O=C(Nc1c(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | c1c |
<|startoftext|><L>O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H]<mask_1:7>CO)Cc1ccc(F)cc1<mask_1:7> | 1 | 35 | 7 | ( | 7 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](C(=O)NCO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | (C(=O)N |
<|startoftext|><L>O=C(N<mask_1:6>Cc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1<mask_1:6> | 7 | 5 | 6 | =c1nc(S | 6 | O=C(N=c1cc(Cc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | =c1cc( |
<|startoftext|><L>O=C(N=c1nc(SCc2ccccc2)<mask_1:5>)N[C@H](CO)Cc1ccc(F)cc1<mask_1:5> | 6 | 22 | 5 | [nH]s1 | 6 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | [nH]s1 |
<|startoftext|><L>O=C(N=c1nc(SC<mask_1:4>2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1<mask_1:4> | 7 | 13 | 4 | c2ccccc | 4 | O=C(N=c1nc(SCC2CC2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | C2CC |
<|startoftext|><L>O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)C<mask_1:6>1ccc(F)cc1<mask_1:6> | 1 | 40 | 6 | c | 6 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)C(=O)Nc1ccc(F)cc1 | O=C(N=c1nc(SCc2ccccc2)[nH]s1)N[C@H](CO)Cc1ccc(F)cc1 | (=O)Nc |
<|startoftext|><L>O=C(<mask_1:6>1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1<mask_1:6> | 4 | 4 | 6 | CCSc | 6 | O=C(/C=C/c1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | /C=C/c |
<|startoftext|><L>O=C(CCSc1ccccc1)N1CCC(<mask_1:4>2nnc(-c3ccco3)s2)CC1<mask_1:4> | 1 | 22 | 4 | c | 4 | O=C(CCSc1ccccc1)N1CCC(CSCc2nnc(-c3ccco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | CSCc |
<|startoftext|><L>O=C(CCSc1c<mask_1:1>1)N1CCC(c2nnc(-c3ccco3)s2)CC1<mask_1:1> | 4 | 10 | 1 | cccc | 1 | O=C(CCSc1cs1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | s |
<|startoftext|><L>O=C(CCS<mask_1:6>c1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1<mask_1:6> | 0 | 7 | 6 | 6 | O=C(CCSC(=O)Nc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | C(=O)N |
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<|startoftext|><L>O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)<mask_1:6>)CC1<mask_1:6> | 2 | 37 | 6 | s2 | 6 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)o2)(CO)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | o2)(CO |
<|startoftext|><L>O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)<mask_1:2>CC1<mask_1:2> | 0 | 40 | 2 | 2 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CCCC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | CC |
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<|startoftext|><L>O=C(CCSc1ccccc1<mask_1:5>CC(c2nnc(-c3ccco3)s2)CC1<mask_1:5> | 4 | 15 | 5 | )N1C | 5 | O=C(CCSc1ccccc1)NCC1CC(c2nnc(-c3ccco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | )NCC1 |
<|startoftext|><L>O=C<mask_1:4>Sc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1<mask_1:4> | 3 | 3 | 4 | (CC | 4 | O=C(NCCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | (NCC |
<|startoftext|><L>O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3c<mask_1:6>co3)s2)CC1<mask_1:6> | 1 | 32 | 6 | c | 6 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3cc(CCO)co3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | c(CCO) |
<|startoftext|><L>O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3<mask_1:4>cco3)s2)CC1<mask_1:4> | 1 | 31 | 4 | c | 4 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3c(O)cco3)s2)CC1 | O=C(CCSc1ccccc1)N1CCC(c2nnc(-c3ccco3)s2)CC1 | c(O) |
<|startoftext|><L>C<mask_1:4>c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:4> | 3 | 1 | 4 | Cn1 | 4 | CCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1 |
<|startoftext|><L>CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])cc<mask_1:9>-c1ccccc1OC<mask_1:9> | 8 | 41 | 9 | c2C)nnc1 | 9 | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | c2Cl)nnc1 |
<|startoftext|><L><mask_1:4>n1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:4> | 2 | 0 | 4 | CC | 4 | C=CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | C=CC |
<|startoftext|><L>CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccc<mask_1:3>cc1OC<mask_1:3> | 0 | 55 | 3 | 3 | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccc(C)cc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | (C) |
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<|startoftext|><L>CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)<mask_1:3>[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:3> | 0 | 34 | 3 | 3 | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O][O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | [O] |
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<|startoftext|><L>CCn1c(S[C@H](C)C(=O)N<mask_1:6>([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:6> | 4 | 21 | 6 | c2cc | 6 | CCn1c(S[C@H](C)C(=O)NCCc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCc2cc |
<|startoftext|><L>CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1cccc<mask_1:5>OC<mask_1:5> | 2 | 56 | 5 | c1 | 5 | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1cccc(C)c1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | (C)c1 |
<|startoftext|><L>CC<mask_1:8>n1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:8> | 0 | 2 | 8 | 8 | CCCCOC(=O)n1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCOC(=O) |
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<|startoftext|><L>CCn1c(S[C@H](C)C(=O<mask_1:7>c([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:7> | 5 | 19 | 7 | )Nc2c | 7 | CCn1c(S[C@H](C)C(=O)c2c(C)c([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | )c2c(C) |
<|startoftext|><L>CCn1c(S[C@H](C)C(=<mask_1:8>c([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC<mask_1:8> | 6 | 18 | 8 | O)Nc2c | 8 | CCn1c(S[C@H](C)C(=O)c2c(C)c([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccccc1OC | O)c2c(C) |
<|startoftext|><L><mask_1:6>N(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2<mask_1:6> | 1 | 0 | 6 | C | 6 | CC(=O)N(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CC(=O) |
<|startoftext|><L>CN(C<mask_1:4>nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2<mask_1:4> | 3 | 4 | 4 | )c1 | 4 | CN(C)Cc1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | )Cc1 |
<|startoftext|><L>CN(C)c1nc2c(c(NC[C<mask_1:2>]3CCCN(S(C)(=O)=O)C3)n1)CCNC2<mask_1:2> | 3 | 18 | 2 | @@H | 2 | CN(C)c1nc2c(c(NC[C@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | @H |
<|startoftext|><L>CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)C<mask_1:3>NC2<mask_1:3> | 1 | 46 | 3 | C | 3 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCCCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CCC |
<|startoftext|><L>CN(C)c1nc2c(c(NC[C<mask_1:2>CN(S(C)(=O)=O)C3)n1)CCNC2<mask_1:2> | 7 | 18 | 2 | @@H]3CC | 2 | CN(C)c1nc2c(c(NC[C]3CN(S(C)(=O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | ]3 |
<|startoftext|><L>CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C<mask_1:2>O)=O)C3)n1)CCNC2<mask_1:2> | 3 | 31 | 2 | )(= | 2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | )( |
<|startoftext|><L>CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)C<mask_1:5>NC2<mask_1:5> | 1 | 46 | 5 | C | 5 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CC(=O)NC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | C(=O) |
<|startoftext|><L>CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1<mask_1:2>CCNC2<mask_1:2> | 1 | 44 | 2 | ) | 2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | )C |
<|startoftext|><L>CN(C)c1nc2c(c<mask_1:4>H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2<mask_1:4> | 7 | 13 | 4 | (NC[C@@ | 4 | CN(C)c1nc2c(c([C@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | ([C@ |
<|startoftext|><L>CN(C<mask_1:7>1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2<mask_1:7> | 2 | 4 | 7 | )c | 7 | CN(C)C(=O)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | CN(C)c1nc2c(c(NC[C@@H]3CCCN(S(C)(=O)=O)C3)n1)CCNC2 | )C(=O)c |
<|startoftext|><L>Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3<mask_1:1>CCC3)c2)cc1<mask_1:1> | 2 | 37 | 1 | CC | 1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | C |
<|startoftext|><L>Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(<mask_1:7>N3CCCCC3)c2)cc1<mask_1:7> | 3 | 32 | 7 | =O) | 7 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)NCCCN3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | =O)NCCC |
<|startoftext|><L>Cc1ccc(CCCNC(=O)c2c<mask_1:6>S(=O)(=O)N3CCCCC3)c2)cc1<mask_1:6> | 7 | 19 | 6 | cc(C)c( | 6 | Cc1ccc(CCCNC(=O)c2cccc(CCS(=O)(=O)N3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | ccc(CC |
<|startoftext|><L>Cc1ccc(CCCNC(=O)c<mask_1:7>c(C)c(S(=O)(=O)N3CCCCC3)c2)cc1<mask_1:7> | 3 | 17 | 7 | 2cc | 7 | Cc1ccc(CCCNC(=O)c2cc(Cl)c(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | 2cc(Cl) |
<|startoftext|><L>Cc1ccc(CCCNC(=<mask_1:5>ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1<mask_1:5> | 4 | 14 | 5 | O)c2 | 5 | Cc1ccc(CCCNC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | O)Nc2 |
<|startoftext|><L>Cc1ccc(CC<mask_1:2>O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1<mask_1:2> | 5 | 9 | 2 | CNC(= | 2 | Cc1ccc(CC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | (= |
<|startoftext|><L>Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c<mask_1:3>cc1<mask_1:3> | 2 | 45 | 3 | 2) | 3 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2C)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | 2C) |
<|startoftext|><L>C<mask_1:4>cc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1<mask_1:4> | 3 | 1 | 4 | c1c | 4 | COc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | Oc1c |
<|startoftext|><L>Cc1ccc(CCCNC(=<mask_1:4>c(C)c(S(=O)(=O)N3CCCCC3)c2)cc1<mask_1:4> | 6 | 14 | 4 | O)c2cc | 4 | Cc1ccc(CCCNC(=O)c2c(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | O)c2 |
<|startoftext|><L>Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3C<mask_1:4>CC3)c2)cc1<mask_1:4> | 2 | 38 | 4 | CC | 4 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCC=CCC3)c2)cc1 | Cc1ccc(CCCNC(=O)c2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)cc1 | CC=C |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C<mask_1:5>[C@@H]1C[C@H]1C(=O)O)CC2<mask_1:5> | 4 | 25 | 5 | (=O) | 5 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)C[C@@H]1C[C@H]1C(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | (=O)C |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O<mask_1:1>)CC2<mask_1:1> | 2 | 47 | 1 | )O | 1 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O))CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | ) |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]<mask_1:3>O)CC2<mask_1:3> | 6 | 42 | 3 | 1C(=O) | 3 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1CCO)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | 1CC |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C(<mask_1:6>C@@H]1C[C@H]1C(=O)O)CC2<mask_1:6> | 4 | 26 | 6 | =O)[ | 6 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)CC[C@@H]1C[C@H]1C(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | =O)CC[ |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O<mask_1:6>)O)CC2<mask_1:6> | 0 | 47 | 6 | 6 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)CC(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | )CC(=O |
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<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O<mask_1:1>C2<mask_1:1> | 2 | 49 | 1 | )C | 1 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)C2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | ) |
<|startoftext|><L>CNS<mask_1:1>O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2<mask_1:1> | 6 | 3 | 1 | (=O)(= | 1 | CNS(O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | ( |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c<mask_1:6>(=O)[C@@H]1C[C@H]1C(=O)O)CC2<mask_1:6> | 5 | 20 | 6 | 1)N(C | 6 | CNS(=O)(=O)c1ccc2c(c1)CN(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | 1)CN(C |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@<mask_1:5>(=O)O)CC2<mask_1:5> | 4 | 40 | 5 | H]1C | 5 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@@H]1C(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | @H]1C |
<|startoftext|><L>CNS(=O)(=O)c1ccc2c(c1<mask_1:3>O)[C@@H]1C[C@H]1C(=O)O)CC2<mask_1:3> | 6 | 21 | 3 | )N(C(= | 3 | CNS(=O)(=O)c1ccc2c(c1C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | CNS(=O)(=O)c1ccc2c(c1)N(C(=O)[C@@H]1C[C@H]1C(=O)O)CC2 | C(= |
<|startoftext|><L>CCn1nc2c(cc1=O)CN(<mask_1:2>c1nc3ccccc3o1)CC2<mask_1:2> | 3 | 18 | 2 | CCC | 2 | CCn1nc2c(cc1=O)CN(CCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CC |
<|startoftext|><L>C<mask_1:3>Cn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2<mask_1:3> | 0 | 1 | 3 | 3 | CCCCCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCC |
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<|startoftext|><L>C<mask_1:5>c2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2<mask_1:5> | 4 | 1 | 5 | Cn1n | 5 | CCCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1n |
<|startoftext|><L>CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3<mask_1:5>o1)CC2<mask_1:5> | 0 | 32 | 5 | 5 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3c(=O)o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | c(=O) |
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<|startoftext|><L>C<mask_1:5>c2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2<mask_1:5> | 4 | 1 | 5 | Cn1n | 5 | CCCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1n |
<|startoftext|><L>CC<mask_1:3>1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2<mask_1:3> | 1 | 2 | 3 | n | 3 | CCCCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn |
<|startoftext|><L>CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1<mask_1:4>2<mask_1:4> | 3 | 34 | 4 | )CC | 4 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CCC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | )CCC |
<|startoftext|><L>CCn1nc2c(cc1=O)C<mask_1:4>CCc1nc3ccccc3o1)CC2<mask_1:4> | 3 | 16 | 4 | N(C | 4 | CCn1nc2c(cc1=O)CCN(CCCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CN(C |
<|startoftext|><L>CCn1nc<mask_1:5>cc1=O)CN(CCCc1nc3ccccc3o1)CC2<mask_1:5> | 3 | 6 | 5 | 2c( | 5 | CCn1nc2c(cccc1=O)CN(CCCc1nc3ccccc3o1)CC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | 2c(cc |
<|startoftext|><L>CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o<mask_1:4>C2<mask_1:4> | 3 | 33 | 4 | 1)C | 4 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CCC2 | CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 | 1)CC |
<|startoftext|><L>Cc1<mask_1:1>cc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21<mask_1:1> | 2 | 3 | 1 | cc | 1 | Cc1scc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | s |
<|startoftext|><L>Cc1cccc(C)c1N1C(=N)S[C<mask_1:2>2CS(=O)(=O)C[C@H]21<mask_1:2> | 3 | 22 | 2 | @H] | 2 | Cc1cccc(C)c1N1C(=N)S[C@]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | @] |
<|startoftext|><L>Cc1cc<mask_1:2>1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21<mask_1:2> | 6 | 5 | 2 | cc(C)c | 2 | Cc1ccsc1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | sc |
<|startoftext|><L>Cc1cccc(C)c1N1C(=N)S<mask_1:2>CS(=O)(=O)C[C@H]21<mask_1:2> | 6 | 20 | 2 | [C@H]2 | 2 | Cc1cccc(C)c1N1C(=N)SC2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | C2 |
<|startoftext|><L>Cc1cccc(C)c1N1C(=N)S[<mask_1:2>@H]2CS(=O)(=O)C[C@H]21<mask_1:2> | 1 | 21 | 2 | C | 2 | Cc1cccc(C)c1N1C(=N)S[C@@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | C@ |
<|startoftext|><L>Cc1cccc(C)c1N<mask_1:1>S[C@H]2CS(=O)(=O)C[C@H]21<mask_1:1> | 6 | 13 | 1 | 1C(=N) | 1 | Cc1cccc(C)c1N1S[C@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | 1 |
<|startoftext|><L>Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O<mask_1:3>H]21<mask_1:3> | 5 | 35 | 3 | )C[C@ | 3 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)[CH]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | )[C |
<|startoftext|><L>Cc1cccc(C)c1N1C(=N)<mask_1:2>S[C@H]2CS(=O)(=O)C[C@H]21<mask_1:2> | 0 | 19 | 2 | 2 | Cc1cccc(C)c1N1C(=N)N=S[C@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | N= |
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<|startoftext|><L>Cc1cccc(<mask_1:2>)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21<mask_1:2> | 1 | 8 | 2 | C | 2 | Cc1cccc(Cl)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | Cl |
<|startoftext|><L>Cc1cc<mask_1:2>1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21<mask_1:2> | 6 | 5 | 2 | cc(C)c | 2 | Cc1ccsc1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | Cc1cccc(C)c1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 | sc |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc<mask_1:5>)cc1)CO3<mask_1:5> | 3 | 35 | 5 | (Cl | 5 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(C(C))cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | (C(C) |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)<mask_1:4>)CO3<mask_1:4> | 3 | 39 | 4 | cc1 | 4 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1F)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | cc1F |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)C<mask_1:6>ccc(Cl)cc1)CO3<mask_1:6> | 5 | 27 | 6 | N(Cc1 | 6 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(CCc1ccc(Cl)cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | N(CCc1 |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1<mask_1:6>Cl)cc1)CO3<mask_1:6> | 4 | 32 | 6 | ccc( | 6 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(OCCl)cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | ccc(OC |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)C<mask_1:6>ccc(Cl)cc1)CO3<mask_1:6> | 5 | 27 | 6 | N(Cc1 | 6 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(CCc1ccc(Cl)cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | N(CCc1 |
<|startoftext|><L>CCc<mask_1:6>(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3<mask_1:6> | 3 | 3 | 6 | 1cc | 6 | CCc1c(C)c(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | 1c(C)c |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(<mask_1:6>c1)CO3<mask_1:6> | 4 | 36 | 6 | Cl)c | 6 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(C)c(C)c1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | C)c(C) |
<|startoftext|><L>CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)c<mask_1:5>1)CO3<mask_1:5> | 1 | 40 | 5 | c | 5 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)c(Cl)c1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | (Cl)c |
<|startoftext|><L>CCc1<mask_1:6>=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3<mask_1:6> | 3 | 4 | 6 | cc( | 6 | CCc1c(C)c(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | c(C)c( |
<|startoftext|><L>C<mask_1:1>Cc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3<mask_1:1> | 0 | 1 | 1 | 1 | CCCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | CCc1cc(=O)oc2c(C)c3c(cc12)CN(Cc1ccc(Cl)cc1)CO3 | C |
Subsets and Splits