smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)n1cnc(S(=O)(=O)[N-]C2C[C@H]3CC[C@@H](C2)N3S(C)(=O)=O)c1	ZINC000217685104	530938630	/nfs/dbraw/zinc/93/86/30/530938630.db2.gz	SMRVFCYDISVLTH-YHWZYXNKSA-N	-1	3	376.504	0.697	50	70		GCIAHM
CS(=O)(=O)[N-]c1cccc2c1ccn2CC(=O)NCCN1CCOCC1	ZINC000218231253	570328326	/nfs/dbraw/zinc/32/83/26/570328326.db2.gz	PDUWILPWQMHZJW-UHFFFAOYSA-N	-1	3	380.470	0.461	50	70		GCIAHM
O=C(Cc1c[nH]c(=O)[n-]c1=O)N[C@H](c1cnc2ccccc2c1)C1CC(O)C1	ZINC000218088878	570324969	/nfs/dbraw/zinc/32/49/69/570324969.db2.gz	HRCGMACGBVMSHH-WOOZHMMNSA-N	-1	3	380.404	0.782	50	70		GCIAHM
O=C(Cc1c[nH]c(=O)[n-]c1=O)N[C@@H](c1cnc2ccccc2c1)C1CC(O)C1	ZINC000218088802	570325024	/nfs/dbraw/zinc/32/50/24/570325024.db2.gz	HRCGMACGBVMSHH-GUUHALQZSA-N	-1	3	380.404	0.782	50	70		GCIAHM
Cc1nc2c(c(=O)[n-]1)CCN(C(=O)CCn1cnc3ccccc3c1=O)CC2	ZINC000217148638	231030531	/nfs/dbraw/zinc/03/05/31/231030531.db2.gz	RIWGXYGZVDSCAL-UHFFFAOYSA-N	-1	3	379.420	0.806	50	70		GCIAHM
O=c1cc(CN2CCOCC2)oc(CN2CCN(CC(F)(F)F)CC2)c1[O-]	ZINC000218560631	570336825	/nfs/dbraw/zinc/33/68/25/570336825.db2.gz	OZBOQORUZXBCAD-UHFFFAOYSA-N	-1	3	391.390	0.858	50	70		GCIAHM