smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1c2c(cc3c1C[C@@]1(C(=O)NC(=O)N(C)C1=O)[C@H](c1c([O-])[nH]c(=O)n(C)c1=O)C3)OCO2	ZINC000009234351	555007713	/nfs/dbraw/zinc/00/77/13/555007713.db2.gz	ADKBAWJVGWFRBU-ANFZBRINSA-N	-1	2	472.410	-0.842	40	0		JBABLM
COc1c2c(cc3c1C[C@@]1(C(=O)NC(=O)N(C)C1=O)[C@H](c1c(=O)[nH]c(=O)n(C)c1[O-])C3)OCO2	ZINC000009234351	555007709	/nfs/dbraw/zinc/00/77/09/555007709.db2.gz	ADKBAWJVGWFRBU-ANFZBRINSA-N	-1	2	472.410	-0.842	40	0		JBABLM
COc1c2c(cc3c1C[C@@]1(C(=O)NC(=O)N(C)C1=O)[C@H](c1c([O-])[nH]c(=O)n(C)c1=O)C3)OCO2	ZINC000009234354	555007664	/nfs/dbraw/zinc/00/76/64/555007664.db2.gz	ADKBAWJVGWFRBU-FPQVQZPGSA-N	-1	2	472.410	-0.842	40	0		JBABLM
COc1c2c(cc3c1C[C@@]1(C(=O)NC(=O)N(C)C1=O)[C@H](c1c(=O)[nH]c(=O)n(C)c1[O-])C3)OCO2	ZINC000009234354	555007660	/nfs/dbraw/zinc/00/76/60/555007660.db2.gz	ADKBAWJVGWFRBU-FPQVQZPGSA-N	-1	2	472.410	-0.842	40	0		JBABLM