Datasets:
cmncomp
/
sm_preprocess

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1
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20
172
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC=C(C=C2)S
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NC(=CS2)C3=C(C=CC=C3F)F
CC(C)N1N=C(CCC1=O)C(=O)OCCN(C)CC=C(C)C
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C=CC(=C2)Cl)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NC=C(C(C)C)S2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C)N=CN=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C=CC=N2)C(F)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCCC2CCCC3=C2C=CC=C3
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC=C(SC(N(C)C)=O)C=C2
CC(C)N1N=C(CCC1=O)C(=O)OCCCC(N)CC2=CC=CC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C[N](N=N2)C3=CC(=C(C=C3)Cl)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCCC2CCCCO2
CC(C)N1N=C(CCC1=O)C(=O)OCCCSCC2=CC=CC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCCC2=CC=C(C=C2)[N](=O)=O
CC(C)N1N=C(CCC1=O)C(=O)OCC2CCCNCC2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NC(=NO2)N(C)C
CC(C)N1N=C(CCC1=O)C(=O)OCCNC2=C(N)C=NC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CSC(=N2)CN
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NOC(=C2)COC3=C(C=CC=C3)F
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC3=C(C=C2)OCO3
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C=C(N)C=C2)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCC2(CC2)C3=CC=CC=C3
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C)C=CC=N2
CC(C)N1N=C(CCC1=O)C(=O)OCCC2=COC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC=C(C=C2)C(F)(F)C(F)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCCCCC2=CC(=C(C=C2)Cl)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C[N](=CC=C2)=O
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2=CC3=C(C=C2)OCC3
CC(C)N1N=C(CCC1=O)C(=O)OCC3=NC(=C2C=CC=CC2=C3)OC
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NOC(=C2)CO
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2=CN=C(C)C=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2(C)CCOCC2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NC(=NO2)C3=CC=C(C=C3)F
CC(C)N1N=C(CCC1=O)C(=O)OCCCC(C)(C)N
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(OC)C(=CC=C2)Br
CC(C)N1N=C(CCC1=O)C(=O)OCC2CC2C(C)C
CC(C)N1N=C(CCC1=O)C(=O)OCCOCC(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCCN(C)C(=O)C2=NC=CC(=C2)N
CC(C)N1N=C(CCC1=O)C(=O)OCC3=C[N](CC2=CC=CC=C2)N=N3
CC(C)N1N=C(CCC1=O)C(=O)OCC2CC2(CC)C
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2=C(C)C=CN=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2CC2(C(C)C)C
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC(=C(OC(C)C)C=C2)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCCC2=NN=C([N]2C)S
CC(C)N1N=C(CCC1=O)C(=O)OCCC2=CN=C[N]2C
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C=C(C=C2)Cl)Br
CC(C)N1N=C(CCC1=O)C(=O)OCC(N)C2=CSC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCCNC2=NC(=CN=C2)Cl
CC(C)N1N=C(CCC1=O)C(=O)OC[C@H](N)C(F)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CC3=C(N=C2)C(=CC=C3)F
CC(C)N1N=C(CCC1=O)C(=O)OCCNCC2CCCCC2
CC(C)N1N=C(CCC1=O)C(=O)OCCN2CCNCC2C
CC(C)N1N=C(CCC1=O)C(=O)OCCN(C)C2=CC=C(C=C2)N
CC(C)N1N=C(CCC1=O)C(=O)OCC2(CN)CCCC2
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2CC3CCC2C3
CC(C)N1N=C(CCC1=O)C(=O)OCCCCC2=CC(=CC=C2)C(F)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCC(CC=CC)N
CC(C)N1N=C(CCC1=O)C(=O)OCCC2=NN=C[N]2C
CC(C)N1N=C(CCC1=O)C(=O)OCC2=CSC(=N2)CN
CC(C)N1N=C(CCC1=O)C(=O)OC2=COC(=CC2=O)C
CC(C)N1N=C(CCC1=O)C(=O)OCCOCC2CC2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C=C(C)C=C2)C
CC(C)N1N=C(CCC1=O)C(=O)OCCSC(F)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCCOC2CCCCC2CC
CC(C)N1N=C(CCC1=O)C(=O)OCC(CC(C)C)N
CC(C)N1N=C(CCC1=O)C(=O)OCCN2C(C(N)CCC2)=O
CC(C)N1N=C(CCC1=O)C(=O)OCCCCCCCCCCCCCCC
CC(C)N1N=C(CCC1=O)C(=O)OCC(CN)CC2=CC(=C(C=C2)F)F
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(OCC)C=CC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2(CCCN(C)C2)C
CC(C)N1N=C(CCC1=O)C(=O)OCC[N]2C=CN=C2C
CC(C)N1N=C(CCC1=O)C(=O)OCC2NCC(C2)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCCSCCCC2=CC=CC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2=CN=CC(=C2)OCC
CC(C)N1N=C(CCC1=O)C(=O)OC[C@H]2CNC(=O)O2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=C(C)OC3=C2C=CC=C3
CC(C)N1N=C(CCC1=O)C(=O)OCCOC2=NC(=CC=C2)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2=CN=CC(=C2)OC
CC(C)N1N=C(CCC1=O)C(=O)OCCC(C)C2CCNCC2
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NC(=NC=C2)Cl
CC(C)N1N=C(CCC1=O)C(=O)OCC2CCCCNC2
CC(C)N1N=C(CCC1=O)C(=O)OCC2CN(CC)C2
CC(C)N1N=C(CCC1=O)C(=O)OCC2(CCC2)C#N
CC(C)N1N=C(CCC1=O)C(=O)OCC2=NC(=CC=C2)C#C
CC(C)N1N=C(CCC1=O)C(=O)OCC3(N)CCN(CC2=CC=CC=C2)CC3
CC(C)N1N=C(CCC1=O)C(=O)OCC(N)C2=CC=C(C=C2)F
CC(C)N1N=C(CCC1=O)C(=O)OCCC(NCC2=CC=C(OC)C=C2)C3=CC=CO3
CC(C)N1N=C(CCC1=O)C(=O)OCCN2CCC(NC)CC2
CC(C)N1N=C(CCC1=O)C(=O)OCC2CN(CC(C)(C)O2)CC3=CC=CC=C3
CC(C)N1N=C(CCC1=O)C(=O)OCCCC2=C(C=C(OC)C=C2)C
CC(C)N1N=C(CCC1=O)C(=O)OCC2(N)CCCC2
CC(C)N1N=C(CCC1=O)C(=O)OCC(C(OC)=O)(C)C2=CC=CC=C2
CC(C)N1N=C(CCC1=O)C(=O)OCC(CC)NC(C)C2=C(C=CC=C2)Br
CC(C)N1N=C(CCC1=O)C(=O)OCC2CNCC(OCCOC)C2
CC(C)N1N=C(CCC1=O)C(=O)OCCN2C(NC(C)(C)C2=O)=O
CC(C)N1N=C(CCC1=O)C(=O)OCCCN2CCCNCC2
CC(C)N1N=C(CCC1=O)C(=O)OC[C@H]2CC[C@H](N)CC2
CC(C)N1N=C(CCC1=O)C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
CC(C)N1N=C(CCC1=O)C(=O)OCC(C)NC2CCCC2[S](=O)(=O)C