smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
S=C(NCc1ccccc1)Nc1ccc2cc3ccccc3[nH+]c2c1	ZINC000409189015	564010880	/nfs/dbraw/zinc/01/08/80/564010880.db2.gz	HDLUUGRJTLPZLX-UHFFFAOYSA-N	1	2	343.455	4.875	40	5		EJBBLO
c1ccc2c(c1)[nH+]c(NCc1ccc3c(c1)OCO3)c1ccccc21	ZINC000031716633	202208767	/nfs/dbraw/zinc/20/87/67/202208767.db2.gz	KWDBVGVYWLJXAF-UHFFFAOYSA-N	1	2	328.371	4.729	40	5		EJBBLO
O[C@@H](Cc1c2ccccc2[nH+]c2ccccc21)C(Cl)(Cl)Cl	ZINC000005338577	563527580	/nfs/dbraw/zinc/52/75/80/563527580.db2.gz	WHMGVUAXBDNPSN-HNNXBMFYSA-N	1	2	340.637	4.662	40	5		EJBBLO
O[C@H](Cc1c2ccccc2[nH+]c2ccccc21)C(Cl)(Cl)Cl	ZINC000005338578	210442639	/nfs/dbraw/zinc/44/26/39/210442639.db2.gz	WHMGVUAXBDNPSN-OAHLLOKOSA-N	1	2	340.637	4.662	40	5		EJBBLO
CC1CCN(C(=S)Nc2ccc3cc4ccccc4[nH+]c3c2)CC1	ZINC000409190629	564010918	/nfs/dbraw/zinc/01/09/18/564010918.db2.gz	UBONXLCYBWWFLY-UHFFFAOYSA-N	1	2	335.476	4.817	40	5		EJBBLO
S=C(Nc1ccc2cc3ccccc3[nH+]c2c1)N1CCCCCC1	ZINC000007098857	564126599	/nfs/dbraw/zinc/12/65/99/564126599.db2.gz	KSFWBMNOZQKKNS-UHFFFAOYSA-N	1	2	335.476	4.961	40	5		EJBBLO