DeepSEQreen_fast_build

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DeepSEQreen_fast_build / data /examples /compound_library.csv

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c8fd31f about 1 year ago

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	ID1,X1
	CHEMBL41355,CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)cc1N
	CHEMBL497318,CCCCCc1cc(O)c(C/C=C(\C)CCC=C(C)C)c(O)c1
	CHEMBL444449,O=c1ccc2c(OCCCCOc3ccccc3)c3ccoc3cc2o1
	CHEMBL305187,CC(C(O)c1ccc(O)cc1)N1CCC(Cc2ccccc2)CC1
	CHEMBL1098,CCCCN1CCCCC1C(=O)Nc1c(C)cccc1C