smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCC[NH3+])N(C)C)cc1	ZINC000911268133	674700948	/nfs/dbraw/zinc/70/09/48/674700948.db2.gz	VEXKJFPMZZCPOZ-AWEZNQCLSA-N	1	3	321.425	-0.454	20	10		DBCDHO
[NH3+][C@H](CC(=O)N1CC(=O)NC[C@@]12CC[NH2+]C2)c1ccccc1[O-]	ZINC001158100969	832089872	/nfs/dbraw/zinc/08/98/72/832089872.db2.gz	DWGRCSLZSWTOGY-WBMJQRKESA-N	1	3	318.377	-0.527	20	10		DBCDHO
[NH3+][C@H](CC(=O)N1CC(=O)NC[C@]12CC[NH2+]C2)c1ccccc1[O-]	ZINC001158100968	832090423	/nfs/dbraw/zinc/09/04/23/832090423.db2.gz	DWGRCSLZSWTOGY-MLGOLLRUSA-N	1	3	318.377	-0.527	20	10		DBCDHO
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCC[NH3+])N(C)C)cc1	ZINC000911268134	674701020	/nfs/dbraw/zinc/70/10/20/674701020.db2.gz	VEXKJFPMZZCPOZ-CQSZACIVSA-N	1	3	321.425	-0.454	20	10		DBCDHO
CN1CCN(c2ccc(CNC(=O)[C@@H](N)C[NH+](C)C)cc2)CC1	ZINC001119374943	829255570	/nfs/dbraw/zinc/25/55/70/829255570.db2.gz	KGHZXEHPVJRQLX-INIZCTEOSA-N	1	3	319.453	-0.057	20	10		DBCDHO
Oc1cc(N2CC[NH2+]CC2)ccc1CN1CC2(C1)CNCCO2	ZINC001222442036	979512924	/nfs/dbraw/zinc/51/29/24/979512924.db2.gz	YZRQQGHGFOTABU-UHFFFAOYSA-N	1	3	318.421	-0.024	20	10		DBCDHO
[NH3+]CCOCCOCCNC(=O)C[C@@H]([NH3+])c1ccccc1[O-]	ZINC001220519191	979224689	/nfs/dbraw/zinc/22/46/89/979224689.db2.gz	FTSWPVBWOHATHX-CYBMUJFWSA-N	1	3	311.382	-0.110	20	10		DBCDHO
CN1CCN(c2ccc(CNC(=O)CNCC[NH3+])cc2)CC1	ZINC001340859406	808660670	/nfs/dbraw/zinc/66/06/70/808660670.db2.gz	ZZWCCPWPGYLLIO-UHFFFAOYSA-N	1	3	305.426	-0.397	20	10		DBCDHO