smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[NH+](CC)Cc1cc(C[NH2+][C@H]2C[C@H]3C(=O)N[C@@H](C(C)C)C(=O)N3C2)ccc1OC	ZINC000014744964	558668721	/nfs/dbraw/zinc/66/87/21/558668721.db2.gz	CXEQMXRPGNUZTD-ZJOUEHCJSA-N	2	0	416.566	1.751	50	10		HDCARP
CC[NH+](CC)Cc1cc(C[NH2+][C@H]2C[C@H]3C(=O)N[C@H](C(C)C)C(=O)N3C2)ccc1OC	ZINC000014744681	558668440	/nfs/dbraw/zinc/66/84/40/558668440.db2.gz	CXEQMXRPGNUZTD-IRFCIJBXSA-N	2	0	416.566	1.751	50	10		HDCARP
C[NH+](C)CCNc1ccc(NCC[NH+](C)C)c2c1C(=O)c1c(O)ccc(O)c1C2=O	ZINC000005115297	557637047	/nfs/dbraw/zinc/63/70/47/557637047.db2.gz	DBAMBJQJKDHEQX-UHFFFAOYSA-N	2	0	412.490	1.820	50	10		HDCARP
[NH3+]CCCNc1ccc2c3c(nn2CC[NH2+]CCO)-c2c(O)ccc(O)c2C(=O)c31	ZINC000001581128	557273835	/nfs/dbraw/zinc/27/38/35/557273835.db2.gz	QEWPVAOWLNMLRI-UHFFFAOYSA-N	2	0	411.462	1.002	50	10	in-man	HDCARP