smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O[C@@]12C[C@@H]3C[C@@H](C[C@@]([NH2+]Cc4ccco4)(C3)C1)C2	ZINC000217937845	183217848	/nfs/dbraw/zinc/21/78/48/183217848.db2.gz	WAHOWIWAUNTOQN-IKARSPCKSA-N	1	0	247.338	2.453	40	70		BEIBRO
CCC[C@H](C)NC(=O)CC1CC[NH+](C)CC1	ZINC000216895377	385875616	/nfs/dbraw/zinc/87/56/16/385875616.db2.gz	NRFHZLOHBFTYHB-NSHDSACASA-N	1	0	226.364	2.023	40	70		BEIBRO
CN(C(=O)C1CC[NH+](C)CC1)C1CCCCC1	ZINC000216923332	188355450	/nfs/dbraw/zinc/35/54/50/188355450.db2.gz	SAEIKAWEARQRQK-UHFFFAOYSA-N	1	0	238.375	2.119	40	70		BEIBRO
CC(C)C(NC(=O)[C@@H]1CCC[N@H+](C)C1)C(C)C	ZINC000216906438	385874870	/nfs/dbraw/zinc/87/48/70/385874870.db2.gz	CWXYEBSTRCRCJN-GFCCVEGCSA-N	1	0	240.391	2.125	40	70		BEIBRO
C[N@@H+]1CCC[C@H]1CCCNC(=O)OC(C)(C)C	ZINC000218325060	173050021	/nfs/dbraw/zinc/05/00/21/173050021.db2.gz	DUZJVPAGCYBSSZ-LLVKDONJSA-N	1	0	242.363	2.386	40	70		BEIBRO
CC(C)C(NC(=O)C1CC[NH+](C)CC1)C(C)C	ZINC000216919775	385874290	/nfs/dbraw/zinc/87/42/90/385874290.db2.gz	AZWLFNIOXGYHSL-UHFFFAOYSA-N	1	0	240.391	2.125	40	70		BEIBRO
C[NH+](C)[SiH2]C(c1ccccc1)c1ccccc1	ZINC000299754693	386487008	/nfs/dbraw/zinc/48/70/08/386487008.db2.gz	HRAMEXCEBWZUEN-UHFFFAOYSA-N	1	0	241.410	2.421	40	70		BEIBRO
CCC(C)(C)NC(=O)CC1CC[NH+](C)CC1	ZINC000216904101	168288529	/nfs/dbraw/zinc/28/85/29/168288529.db2.gz	MAZBZGIKIGJCBW-UHFFFAOYSA-N	1	0	226.364	2.023	40	70		BEIBRO
CN(C(=O)[C@@H]1CCC[N@H+](C)C1)C1CCCCC1	ZINC000216916062	323092272	/nfs/dbraw/zinc/09/22/72/323092272.db2.gz	GSQQRAYESXJTKI-GFCCVEGCSA-N	1	0	238.375	2.119	40	70		BEIBRO
CC(C)C(NC(=O)[C@H]1CCC[N@H+](C)C1)C(C)C	ZINC000216906471	385874461	/nfs/dbraw/zinc/87/44/61/385874461.db2.gz	CWXYEBSTRCRCJN-LBPRGKRZSA-N	1	0	240.391	2.125	40	70		BEIBRO
CCC[C@@H](C)NC(=O)CC1CC[NH+](C)CC1	ZINC000216895342	169367925	/nfs/dbraw/zinc/36/79/25/169367925.db2.gz	NRFHZLOHBFTYHB-LLVKDONJSA-N	1	0	226.364	2.023	40	70		BEIBRO
CN(C(=O)[C@H]1CCC[N@H+](C)C1)C1CCCCC1	ZINC000216916089	173038958	/nfs/dbraw/zinc/03/89/58/173038958.db2.gz	GSQQRAYESXJTKI-LBPRGKRZSA-N	1	0	238.375	2.119	40	70		BEIBRO
C[N@@H+]1CCC[C@@H]1CCCNC(=O)OC(C)(C)C	ZINC000218324990	173027125	/nfs/dbraw/zinc/02/71/25/173027125.db2.gz	DUZJVPAGCYBSSZ-NSHDSACASA-N	1	0	242.363	2.386	40	70		BEIBRO