smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)SC(=S)N(Cc2ccccc2)C1[N+](=O)Cc1c(F)cccc1Cl	ZINC000004785577	559063746	/nfs/dbraw/zinc/06/37/46/559063746.db2.gz	XIJPGMWAXSHAFE-QWUOEIFBSA-N	1	3	408.951	5.047	50	30		HKEAHO
CC1(C)SC(=S)N(Cc2ccccc2)C1[N+](=O)Cc1c(F)cccc1Cl	ZINC000004785578	559063782	/nfs/dbraw/zinc/06/37/82/559063782.db2.gz	XIJPGMWAXSHAFE-NSTHGIQOSA-N	1	3	408.951	5.047	50	30		HKEAHO
CCCC(CC)(CC)N1CN(C(CC)(CC)CCC)C[P+](C)(c2ccccc2)C1	ZINC000019322939	558867497	/nfs/dbraw/zinc/86/74/97/558867497.db2.gz	QCHJCBHRLKZPCG-UHFFFAOYSA-N	1	3	419.658	7.167	50	30		HKEAHO
CN(C)Cc1ccc(-c2ccccc2C[NH2+]Cc2ccc(N(C)CCC#N)cc2)cc1	ZINC000030669454	521892761	/nfs/dbraw/zinc/89/27/61/521892761.db2.gz	UOJCIZDHAGDZKG-UHFFFAOYSA-N	1	3	412.581	5.055	50	30		HKEAHO