smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N@@H+](Cc1ccnc(C(C)C)n1)[C@H](C)Cc1ccc(OC)cc1	ZINC000218588223	241333559	/nfs/dbraw/zinc/33/35/59/241333559.db2.gz	XTPDPYUDDQTBPX-MRXNPFEDSA-N	1	1	327.472	4.062	50	70		EIIAMO
CC[N@@H+](Cc1ccnc(C(C)C)n1)[C@@H](C)Cc1ccc(OC)cc1	ZINC000218588165	241333304	/nfs/dbraw/zinc/33/33/04/241333304.db2.gz	XTPDPYUDDQTBPX-INIZCTEOSA-N	1	1	327.472	4.062	50	70		EIIAMO
c1sc(C2CC2)nc1C[NH+]1CCC(OCc2ccccc2)CC1	ZINC000161394884	564125373	/nfs/dbraw/zinc/12/53/73/564125373.db2.gz	IHTUJELWWZMPOM-UHFFFAOYSA-N	1	1	328.481	4.202	50	70		EIIAMO
c1cc([C@H]2CCCO2)sc1C[N@H+]1CCCN(c2ccccc2)CC1	ZINC000216868327	241217102	/nfs/dbraw/zinc/21/71/02/241217102.db2.gz	COLQWGWHGVHNNN-LJQANCHMSA-N	1	1	342.508	4.312	50	70		EIIAMO
CN(Cc1ccc([C@H]2CCCCO2)o1)Cc1ccc2c(c1)C[N@H+](C)C2	ZINC000217850822	241278753	/nfs/dbraw/zinc/27/87/53/241278753.db2.gz	GFWYFHQUZADSDD-HXUWFJFHSA-N	1	1	340.467	4.099	50	70		EIIAMO
CC(C)C(=O)Nc1ccc(SC[C@@H]2CCC[N@H+]3CCCC[C@H]23)nc1	ZINC000218062785	241296578	/nfs/dbraw/zinc/29/65/78/241296578.db2.gz	SZPCATKYZXNXET-DOTOQJQBSA-N	1	1	347.528	4.033	50	70		EIIAMO
O[C@@]12CCCC[C@@H]1C[N@H+](Cc1csc(Nc3ccccc3)n1)CC2	ZINC000161117280	564116906	/nfs/dbraw/zinc/11/69/06/564116906.db2.gz	VVZSLQXGIPZXFA-DNVCBOLYSA-N	1	1	343.496	4.014	50	70		EIIAMO
O[C@@]12CCCC[C@@H]1C[N@@H+](Cc1csc(Nc3ccccc3)n1)CC2	ZINC000161117280	564116907	/nfs/dbraw/zinc/11/69/07/564116907.db2.gz	VVZSLQXGIPZXFA-DNVCBOLYSA-N	1	1	343.496	4.014	50	70		EIIAMO
O[C@]12CCCC[C@@H]1C[N@H+](Cc1csc(Nc3ccccc3)n1)CC2	ZINC000161117403	225552692	/nfs/dbraw/zinc/55/26/92/225552692.db2.gz	VVZSLQXGIPZXFA-BEFAXECRSA-N	1	1	343.496	4.014	50	70		EIIAMO
O[C@]12CCCC[C@@H]1C[N@@H+](Cc1csc(Nc3ccccc3)n1)CC2	ZINC000161117403	225552696	/nfs/dbraw/zinc/55/26/96/225552696.db2.gz	VVZSLQXGIPZXFA-BEFAXECRSA-N	1	1	343.496	4.014	50	70		EIIAMO
CCn1ccc2ccc(C[N@H+]3CCN(C)[C@@H](c4ccccc4)C3)cc21	ZINC000217216708	241241642	/nfs/dbraw/zinc/24/16/42/241241642.db2.gz	NGCFKIXPXHBZDW-JOCHJYFZSA-N	1	1	333.479	4.150	50	70		EIIAMO