smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(S[C@@H]2C[C@@H](C(=O)N(C)Cc3cc[nH]n3)[N@H+](Cc3cc(Cl)ccc3O)C2)cc1	ZINC000014990749	525109106	/nfs/dbraw/zinc/10/91/06/525109106.db2.gz	MZQBMXGTBNAZNR-YADHBBJMSA-N	1	0	487.025	4.171	10	10		JICERO
O=C(NCCc1ccccc1F)[C@@H]1C[C@H]([NH2+]Cc2ccccc2O)CN1Cc1cccc(Cl)c1	ZINC000020910204	195245817	/nfs/dbraw/zinc/24/58/17/195245817.db2.gz	FVQKMVMDDNWZDO-ZCYQVOJMSA-N	1	0	481.999	4.276	10	10		JICERO
COc1ccc(N2CCN(c3nccc4ccc(C(=O)NCCC[NH+]5CCCCC5)cc43)CC2)cc1	ZINC000065002080	524437692	/nfs/dbraw/zinc/43/76/92/524437692.db2.gz	UUKIXZKDPRQYGG-UHFFFAOYSA-N	1	0	487.648	4.176	10	10		JICERO
CCN1C(=O)N(Cc2cccc(OC)c2)C(=O)C12CC[NH+](C/C=C/c1ccc(N(C)C)cc1)CC2	ZINC000014743048	521526849	/nfs/dbraw/zinc/52/68/49/521526849.db2.gz	QLJCEWXLWNOPQK-VQHVLOKHSA-N	1	0	476.621	4.093	10	10		JICERO
COCCCN1C(=O)N(Cc2ccccc2)C(=O)C12CC[NH+](Cc1ccc(N3CCCC3)cc1)CC2	ZINC000014745277	523289091	/nfs/dbraw/zinc/28/90/91/523289091.db2.gz	IXEHTKCIWDOMEQ-UHFFFAOYSA-N	1	0	490.648	4.122	10	10		JICERO