smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N+](C)(C)[C@H](Cc1cnc(SC[C@@H](O)[C@H]([NH3+])C(=O)[O-])[nH]1)C(=O)[O-]	ZINC000013403330	717107976	/nfs/dbraw/zinc/10/79/76/717107976.db2.gz	PBGMXJHSCOZVQW-BBBLOLIVSA-O	0	1	347.417	-1.024	1	30		EAEFMN
NC(=O)C[C@H](NC(=O)[C@@H](N)CCCNC(N)=N[N+](=O)[O-])C(N)=O	ZINC000026951411	202149865	/nfs/dbraw/zinc/14/98/65/202149865.db2.gz	IEIOMLYCWDWBRV-WDSKDSINSA-N	0	1	332.321	-3.965	1	30		EAEFMN
C[C@H](NC(=O)[C@@H](N)CCCNC(N)=[NH2+])C(=O)N1CCC[C@@H]1C(=O)[O-]	ZINC000027311554	212552079	/nfs/dbraw/zinc/55/20/79/212552079.db2.gz	DBKNLHKEVPZVQC-LPEHRKFASA-N	0	1	342.400	-2.052	1	30		EAEFMN
C[C@@H](NC(=O)[C@@H]([NH3+])CCCNC(N)=N[N+](=O)[O-])[P@](=O)([O-])O	ZINC000027322921	202153617	/nfs/dbraw/zinc/15/36/17/202153617.db2.gz	MRLBPFGHTJWKGZ-WDSKDSINSA-N	0	1	326.250	-2.170	1	30		EAEFMN
C[C@H](Cn1cnc2c1nc(N)nc2NC(N)=[NH2+])OC[P@](=O)([O-])O	ZINC000029123087	202181540	/nfs/dbraw/zinc/18/15/40/202181540.db2.gz	SWXLOIHTYGQDFM-RXMQYKEDSA-N	0	1	344.272	-1.146	1	30		EAEFMN
N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)N(CC(=O)NO)C1=O	ZINC000073224314	216367318	/nfs/dbraw/zinc/36/73/18/216367318.db2.gz	GQDDAOPNVIIXCD-QWRGUYRKSA-N	0	1	334.332	-1.695	1	30		EAEFMN
C[C@@H](Cn1c2ncnc-2c(N)nc1NC(N)=[NH2+])OC[P@](=O)([O-])O	ZINC000101147289	219117769	/nfs/dbraw/zinc/11/77/69/219117769.db2.gz	ODIYKRZBDNCIIW-YFKPBYRVSA-N	0	1	344.272	-1.195	1	30		EAEFMN
C[C@H](Cn1c2ncnc-2c(N)nc1NC(N)=[NH2+])OC[P@](=O)([O-])O	ZINC000101458930	204008210	/nfs/dbraw/zinc/00/82/10/204008210.db2.gz	ODIYKRZBDNCIIW-RXMQYKEDSA-N	0	1	344.272	-1.195	1	30		EAEFMN
COc1cc(O)cc2c1C(=O)C1=C(C2=O)[C@H](O)[C@](C)(O)[C@H](O)[C@H]1O	ZINC000103241680	219274571	/nfs/dbraw/zinc/27/45/71/219274571.db2.gz	MJWABJMLXRFZIX-JONQDZQNSA-N	0	1	336.296	-1.076	1	30		EAEFMN
COc1cc(O)cc2c1C(=O)C1=C(C2=O)[C@@H](O)[C@](C)(O)[C@H](O)[C@H]1O	ZINC000103241682	219274241	/nfs/dbraw/zinc/27/42/41/219274241.db2.gz	MJWABJMLXRFZIX-JJXSEGSLSA-N	0	1	336.296	-1.076	1	30		EAEFMN
NCC(=O)N[C@@H](CCCNC(N)=[NH2+])C(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000146826631	685068605	/nfs/dbraw/zinc/06/86/05/685068605.db2.gz	VXKCPBPQEKKERH-IUCAKERBSA-N	0	1	328.373	-2.441	1	30		EAEFMN
NC(=NO)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c2ncnc(NO)c12	ZINC000256832562	685760509	/nfs/dbraw/zinc/76/05/09/685760509.db2.gz	VDRNYDUPTSTUEE-ADVRJHOBSA-N	0	1	340.296	-2.062	1	30		EAEFMN
NC(=NO)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c2ncnc(NO)c12	ZINC000256832564	685760467	/nfs/dbraw/zinc/76/04/67/685760467.db2.gz	VDRNYDUPTSTUEE-IZRASGFBSA-N	0	1	340.296	-2.062	1	30		EAEFMN