smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)c1cnc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@H]2C)c(S(=O)(=O)F)c1	ZINC001164862538	721021908	/nfs/dbraw/zinc/02/19/08/721021908.db2.gz	QSJZVOUXURNAEP-CYBMUJFWSA-N	1	2	439.513	2.144	20	70		IEIDLO
COC(=O)c1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@H]2C)c(S(=O)(=O)F)c1	ZINC001164862538	721021914	/nfs/dbraw/zinc/02/19/14/721021914.db2.gz	QSJZVOUXURNAEP-CYBMUJFWSA-N	1	2	439.513	2.144	20	70		IEIDLO
COC(=O)c1cnc(N2CCn3c(C[N@H+](C)C(C)C)cnc3[C@@H]2C)c(S(=O)(=O)F)c1	ZINC001164862542	721022035	/nfs/dbraw/zinc/02/20/35/721022035.db2.gz	QSJZVOUXURNAEP-ZDUSSCGKSA-N	1	2	439.513	2.144	20	70		IEIDLO
COC(=O)c1cnc(N2CCn3c(C[N@@H+](C)C(C)C)cnc3[C@@H]2C)c(S(=O)(=O)F)c1	ZINC001164862542	721022042	/nfs/dbraw/zinc/02/20/42/721022042.db2.gz	QSJZVOUXURNAEP-ZDUSSCGKSA-N	1	2	439.513	2.144	20	70		IEIDLO
O=S(=O)(F)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@H+](Cc4ccccn4)C3)C2)nn1	ZINC001164911634	721725377	/nfs/dbraw/zinc/72/53/77/721725377.db2.gz	JTTMJBPSDCVGEZ-QGZVFWFLSA-N	1	2	427.452	2.268	20	70		IEIDLO
O=S(=O)(F)c1ccc(N2CCC(F)(F)[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nn1	ZINC001164911634	721725382	/nfs/dbraw/zinc/72/53/82/721725382.db2.gz	JTTMJBPSDCVGEZ-QGZVFWFLSA-N	1	2	427.452	2.268	20	70		IEIDLO
O=S(=O)(F)c1ccc(N2CCC(F)(F)[C@]3(CC[N@H+](Cc4ccccn4)C3)C2)nn1	ZINC001164911630	721725425	/nfs/dbraw/zinc/72/54/25/721725425.db2.gz	JTTMJBPSDCVGEZ-KRWDZBQOSA-N	1	2	427.452	2.268	20	70		IEIDLO
O=S(=O)(F)c1ccc(N2CCC(F)(F)[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2)nn1	ZINC001164911630	721725429	/nfs/dbraw/zinc/72/54/29/721725429.db2.gz	JTTMJBPSDCVGEZ-KRWDZBQOSA-N	1	2	427.452	2.268	20	70		IEIDLO