smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(O)c(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1C	ZINC000237232687	853987704	/nfs/dbraw/zinc/98/77/04/853987704.db2.gz	DNSFMYYKEIOJII-UHFFFAOYSA-N	2	0	407.480	4.069	20	10		HICDRP
CCN1CC[NH+](CCCC[NH2+]Cc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)CC1	ZINC000236876355	853931301	/nfs/dbraw/zinc/93/13/01/853931301.db2.gz	RVGZYXVYAWINGV-UHFFFAOYSA-N	2	0	403.655	4.495	20	10		HICDRP
COc1cccc(C[NH2+]Cc2ccccc2C[NH+]2CCN(c3ccccc3)CC2)c1O	ZINC000237497995	854044995	/nfs/dbraw/zinc/04/49/95/854044995.db2.gz	URSQBPLAMLIAPB-UHFFFAOYSA-N	2	0	417.553	4.013	20	10		HICDRP
CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)Nc2cccc(C[NH+](C)C)c2)C1	ZINC000435547813	860862696	/nfs/dbraw/zinc/86/26/96/860862696.db2.gz	KDARJWDOAWOXSU-UHFFFAOYSA-N	2	0	404.558	4.108	20	10		HICDRP
CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)Nc2ccccc2CC[NH+](C)C)C1	ZINC000436015410	861305777	/nfs/dbraw/zinc/30/57/77/861305777.db2.gz	HTEVKCCCLBWWSO-UHFFFAOYSA-N	2	0	418.585	4.151	20	10		HICDRP
C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(N2CCOCC2)c(F)c1	ZINC000237180375	853976196	/nfs/dbraw/zinc/97/61/96/853976196.db2.gz	PGIAWJJSWDQNFM-UHFFFAOYSA-N	2	0	423.532	4.177	20	10		HICDRP
CC(C)[N@@H+]1CCc2c(c3ccccc3n2Cc2nc(-c3ccn4c[nH+]cc4c3)no2)C1	ZINC000564277420	945489752	/nfs/dbraw/zinc/48/97/52/945489752.db2.gz	QNBRFRGVZYVYCS-UHFFFAOYSA-N	2	0	412.497	4.154	20	10		HICDRP
CCN(Cc1ccccc1)c1ccc(C[NH2+]C2CCN(C3CC[NH+](C)CC3)CC2)cc1	ZINC000236970801	853944108	/nfs/dbraw/zinc/94/41/08/853944108.db2.gz	RPZZVDFZWWFSIR-UHFFFAOYSA-N	2	0	420.645	4.361	20	10		HICDRP
COc1ccc(C[NH2+]Cc2cc(C(F)(F)F)ccc2N2CC[NH+](C)CC2)cc1C	ZINC000237431618	854032256	/nfs/dbraw/zinc/03/22/56/854032256.db2.gz	RLORIEQZAHCJOA-UHFFFAOYSA-N	2	0	407.480	4.064	20	10		HICDRP
Cc1ccc(NC(=O)Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)c(C[NH+](C)C)c1	ZINC000435854743	861114320	/nfs/dbraw/zinc/11/43/20/861114320.db2.gz	HQOFQFNWOWVJPQ-UHFFFAOYSA-N	2	0	418.585	4.417	20	10		HICDRP
CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(C[NH+](C)C)cc2)C1	ZINC000443913182	868448561	/nfs/dbraw/zinc/44/85/61/868448561.db2.gz	LGEGDCUFIFESFY-UHFFFAOYSA-N	2	0	404.558	4.108	20	10		HICDRP
C[N@H+](Cc1ccco1)Cc1ccccc1C[NH2+]Cc1ccc(N2CCOCC2)cc1	ZINC000237180415	853976784	/nfs/dbraw/zinc/97/67/84/853976784.db2.gz	XURASSWAXAECSB-UHFFFAOYSA-N	2	0	405.542	4.038	20	10		HICDRP
CC[NH+](CC)CCC[C@@H](C)NC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2	ZINC000443986117	868510774	/nfs/dbraw/zinc/51/07/74/868510774.db2.gz	ZIICSZAOHQKNCT-HXUWFJFHSA-N	2	0	412.622	4.035	20	10		HICDRP
CC[NH+](CC)CCC[C@H](C)NC(=O)Cn1c2ccccc2c2c1CC[N@H+](C(C)C)C2	ZINC000443986104	868510966	/nfs/dbraw/zinc/51/09/66/868510966.db2.gz	ZIICSZAOHQKNCT-FQEVSTJZSA-N	2	0	412.622	4.035	20	10		HICDRP
c1ccc(N2CC[NH+](Cc3ccccc3C[NH2+]Cc3ccc4c(c3)CCO4)CC2)cc1	ZINC000236647638	853907156	/nfs/dbraw/zinc/90/71/56/853907156.db2.gz	LQUQUJJLHMRCJC-UHFFFAOYSA-N	2	0	413.565	4.234	20	10		HICDRP
Cc1cc(C[NH+](C)C)cc(NC(=O)Cn2c3ccccc3c3c2CC[N@@H+](C(C)C)C3)c1	ZINC000444329630	868756181	/nfs/dbraw/zinc/75/61/81/868756181.db2.gz	PPKKDPLZRCQBHM-UHFFFAOYSA-N	2	0	418.585	4.417	20	10		HICDRP
Oc1ccccc1C[NH2+]CCCC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000238097897	854142480	/nfs/dbraw/zinc/14/24/80/854142480.db2.gz	SWHYFTZJTZAJAE-UHFFFAOYSA-N	2	0	407.480	4.103	20	10		HICDRP
CC(C)[N@@H+]1CCc2c(c3ccccc3n2CC(=O)Nc2ccc(CC[NH+](C)C)cc2)C1	ZINC000435733487	861015086	/nfs/dbraw/zinc/01/50/86/861015086.db2.gz	BYLAMWFVIYHMEB-UHFFFAOYSA-N	2	0	418.585	4.151	20	10		HICDRP
O=C(Nc1cccc(N2CC[NH+](CC3CC3)CC2)c1)c1cccc(C[NH+]2CCCC2)c1	ZINC000139372480	853408697	/nfs/dbraw/zinc/40/86/97/853408697.db2.gz	XNEZTGAAFMTJQC-UHFFFAOYSA-N	2	0	418.585	4.067	20	10		HICDRP