smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2C[N@H+](C)CCN32)C1=O	ZINC000009487893	523931021	/nfs/dbraw/zinc/93/10/21/523931021.db2.gz	QVXGRVDKXSNWIX-MJSCBBHESA-N	1	1	494.508	-0.509	50	10		JBCAMO
CN1C(=O)NC(=O)/C(=C/c2ccc3c(c2)CC2(C(=O)N(C)C(=O)N(C)C2=O)[C@@H]2C[N@@H+](C)CCN32)C1=O	ZINC000009487893	523931015	/nfs/dbraw/zinc/93/10/15/523931015.db2.gz	QVXGRVDKXSNWIX-MJSCBBHESA-N	1	1	494.508	-0.509	50	10		JBCAMO
COc1ccc(N2CC[NH+](CCNC(=O)Cn3ccc4c3n(C)c(=O)n(C)c4=O)CC2)cc1	ZINC000013353332	555381543	/nfs/dbraw/zinc/38/15/43/555381543.db2.gz	JKSPQMBWSAVGRH-UHFFFAOYSA-N	1	1	454.531	-0.014	50	10		JBCAMO
CN1C(=O)C(=CNc2ccc3c(c2)CC2(C(=O)NC(=O)NC2=O)[C@@H]2C[N@H+](C)CCN32)C(=O)N(C)C1=O	ZINC000016956872	556187646	/nfs/dbraw/zinc/18/76/46/556187646.db2.gz	CTVHNTQXJHVYLU-INIZCTEOSA-N	1	1	495.496	-0.938	50	10		JBCAMO