smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc2c3c(c1O)Oc1ccc(cc1)C[C@H]1c4cc(c(OC)cc4CC[N@H+]1C)Oc1cc(ccc1O)C[C@H]3[N+](C)(C)CC2	ZINC000003978083	552424510	/nfs/dbraw/zinc/42/45/10/552424510.db2.gz	JFJZZMVDLULRGK-URLMMPGGSA-O	2	1	609.743	6.701	50	5	biogenic,world	KKBAMP
C[n+]1ccccc1-c1c2ccc(n2)c(-c2cccc[n+]2C)c2ccc([nH]2)c(-c2cccc[n+]2C)c2ccc(n2)c(-c2cccc[n+]2C)c2ccc1[nH]2	ZINC000027519009	553826755	/nfs/dbraw/zinc/82/67/55/553826755.db2.gz	QCZAJOVYBIIPDI-UHFFFAOYSA-O	4	1	678.844	6.836	50	5		KKBAMP
Nc1ccc2c3ccc(N)cc3[n+](CCC[NH2+]CC[NH2+]CCC[n+]3c4cc(N)ccc4c4ccc(N)cc4c3-c3ccccc3)c(-c3ccccc3)c2c1	ZINC000095566015	553704669	/nfs/dbraw/zinc/70/46/69/553704669.db2.gz	CTTVIEYMZPRCCH-UHFFFAOYSA-P	4	1	712.946	7.197	50	5		KKBAMP
COc1cc2c3c(c1O)Oc1ccc(cc1)C[C@@H]1c4cc(c(OC)cc4CC[N@H+]1C)Oc1cc(ccc1O)C[C@H]3[N+](C)(C)CC2	ZINC000004198852	552448429	/nfs/dbraw/zinc/44/84/29/552448429.db2.gz	JFJZZMVDLULRGK-FQLXRVMXSA-O	2	1	609.743	6.701	50	5	biogenic,in-vitro	KKBAMP
C[n+]1cccc(-c2c3ccc(n3)c(-c3ccc[n+](C)c3)c3ccc([nH]3)c(-c3ccc[n+](C)c3)c3ccc(n3)c(-c3ccc[n+](C)c3)c3ccc2[nH]3)c1	ZINC000150339051	1071326242	/nfs/dbraw/zinc/32/62/42/1071326242.db2.gz	JPPCDPGSXNYZST-UHFFFAOYSA-N	4	1	678.844	6.836	50	5		KKBAMP