smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC1=Nc2c(nc3cc(Cl)ccc3c2/N=C2\C=C(CN3CCCC3)C(=O)C(C[NH+]3CCCC3)=C2)CC1	ZINC000015951916	553545592	/nfs/dbraw/zinc/54/55/92/553545592.db2.gz	YFYLPWJKCSESGB-UHFFFAOYSA-N	1	3	518.061	4.477	10	30	world	KIEEHO
COC1=Nc2c(nc3cc(Cl)ccc3c2/N=C2/C=C(CN3CCCC3)C(=O)C(C[NH+]3CCCC3)=C2)CC1	ZINC000015951916	553545590	/nfs/dbraw/zinc/54/55/90/553545590.db2.gz	YFYLPWJKCSESGB-UHFFFAOYSA-N	1	3	518.061	4.477	10	30	world	KIEEHO
COC1=Nc2c(nc3cc(Cl)ccc3c2N=C2C=C(CN3CCCC3)C(=O)C(C[NH+]3CCCC3)=C2)CC1	ZINC000015951916	553545588	/nfs/dbraw/zinc/54/55/88/553545588.db2.gz	YFYLPWJKCSESGB-UHFFFAOYSA-N	1	3	518.061	4.477	10	30	world	KIEEHO