smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1[nH]cc([C@H]2[C@H](CNC(=O)c3cc(Br)c[nH]3)[C@@H](CNC(=O)c3cc(Br)c[nH]3)[C@@H]2c2c[nH]c(N)[nH+]2)[nH+]1	ZINC000026378494	561782894	/nfs/dbraw/zinc/78/28/94/561782894.db2.gz	YPZNLFZLPZWWAD-GWIYSAMLSA-N	2	1	620.310	2.452	10	0	in-vitro	KEAEMP
Nc1[nH]cc([C@H]2[C@H](CNC(=O)c3cc(Br)c[nH]3)[C@@H](CNC(=O)c3cc(Br)c[nH]3)[C@@H]2c2c[nH+]c(N)[nH]2)[nH+]1	ZINC000026378494	561782893	/nfs/dbraw/zinc/78/28/93/561782893.db2.gz	YPZNLFZLPZWWAD-GWIYSAMLSA-N	2	1	620.310	2.452	10	0	in-vitro	KEAEMP
C[NH+]1CC[C@@]23c4c5c(O)c(-c6cc7c8c(c6O)O[C@H]6[C@@H](O)C=C[C@H]9[C@@H](C7)[N@@H+](C)CC[C@]869)cc4C[C@@H]1[C@@H]2C=C[C@H](O)[C@@H]3O5	ZINC000077312677	553663969	/nfs/dbraw/zinc/66/39/69/553663969.db2.gz	FOJYFDFNGPRXDR-SQILNHJXSA-N	2	1	568.670	2.377	10	0	in-vitro	KEAEMP
Nc1cc(N2CC[NH+](CC[P@](=O)([O-])O)CC2)nc(NCC2CCC(C[NH2+]CCC[NH2+]C3CCCCC3)CC2)n1	ZINC000140585706	562833202	/nfs/dbraw/zinc/83/32/02/562833202.db2.gz	QLVSJMZJSABWRX-UHFFFAOYSA-N	2	1	566.732	2.479	10	0	in-man	KEAEMP