smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(=O)[n-]c(S[C@@H](C)C(=O)NCc2nnnn2-c2ccccc2)n1	ZINC000217635293	526122370	/nfs/dbraw/zinc/12/23/70/526122370.db2.gz	AYMJQRCOBACBSN-NSHDSACASA-N	-1	1	371.426	0.851	50	70		FCIAMM
Cn1cc([C@H](CC(N)=O)c2c(Cc3ccc4c(c3)CCO4)[n-][nH]c2=O)cn1	ZINC000218551132	527312861	/nfs/dbraw/zinc/31/28/61/527312861.db2.gz	WHMBHTKBDWDACR-AWEZNQCLSA-N	-1	1	367.409	0.970	50	70		FCIAMM
Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1cc2cc3c(cc2[nH]c1=O)OCO3	ZINC000218323274	206368626	/nfs/dbraw/zinc/36/86/26/206368626.db2.gz	QXUHIEMODVKPDW-SECBINFHSA-N	-1	1	356.338	0.589	50	70		FCIAMM
Cc1nc2[n-]cnn2c(=O)c1CCC(=O)N[C@H](CO)Cc1ccccc1	ZINC000218406634	525449428	/nfs/dbraw/zinc/44/94/28/525449428.db2.gz	DRNMTEQTSZDEOZ-AWEZNQCLSA-N	-1	1	355.398	0.378	50	70		FCIAMM
Cc1cc(=O)[n-]c(S[C@H](C)C(=O)NCc2nnnn2-c2ccccc2)n1	ZINC000217635375	526121765	/nfs/dbraw/zinc/12/17/65/526121765.db2.gz	AYMJQRCOBACBSN-LLVKDONJSA-N	-1	1	371.426	0.851	50	70		FCIAMM
Cn1cc([C@@H](CC(N)=O)c2c(Cc3ccc4c(c3)CCO4)[n-][nH]c2=O)cn1	ZINC000218551047	527292828	/nfs/dbraw/zinc/29/28/28/527292828.db2.gz	WHMBHTKBDWDACR-CQSZACIVSA-N	-1	1	367.409	0.970	50	70		FCIAMM
Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1cc2cc3c(cc2[nH]c1=O)OCO3	ZINC000218323365	488442914	/nfs/dbraw/zinc/44/29/14/488442914.db2.gz	QXUHIEMODVKPDW-VIFPVBQESA-N	-1	1	356.338	0.589	50	70		FCIAMM
O=C(Cc1cc(=O)[n-][nH]c1=O)N[C@@H]1CCOC[C@H]1OCc1ccccc1	ZINC000218122701	527207508	/nfs/dbraw/zinc/20/75/08/527207508.db2.gz	NJPBEWIENMECJS-HUUCEWRRSA-N	-1	1	359.382	0.096	50	70		FCIAMM