smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](NC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O)C(=O)N[C@H](CC(N)=O)C(=O)[O-]	ZINC000002604137	554240430	/nfs/dbraw/zinc/24/04/30/554240430.db2.gz	NKZUYPXFECRHNI-RSBGCTCZSA-N	-1	2	451.823	-0.770	50	10		JBCALM
C[C@@H](NC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O)C(=O)N[C@@H](CC(N)=O)C(=O)[O-]	ZINC000020462986	525031628	/nfs/dbraw/zinc/03/16/28/525031628.db2.gz	NKZUYPXFECRHNI-KBKYEYNWSA-N	-1	2	451.823	-0.770	50	10		JBCALM
C[C@H](NC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O)C(=O)N[C@@H](CC(N)=O)C(=O)[O-]	ZINC000020462989	524871891	/nfs/dbraw/zinc/87/18/91/524871891.db2.gz	NKZUYPXFECRHNI-ICKMXJIXSA-N	-1	2	451.823	-0.770	50	10		JBCALM
C[C@H](NC=C1C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O)C(=O)N[C@H](CC(N)=O)C(=O)[O-]	ZINC000020462996	524870342	/nfs/dbraw/zinc/87/03/42/524870342.db2.gz	NKZUYPXFECRHNI-PGNPSOMDSA-N	-1	2	451.823	-0.770	50	10		JBCALM