smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C)cc(C(=O)N2CCN(c3nc(N4CC[NH+](C)CC4)cc(C)[nH+]3)CC2)c1	ZINC000009620769	132341748	/nfs/dbraw/zinc/34/17/48/132341748.db2.gz	WUKHVCPPKAKOFY-UHFFFAOYSA-N	2	2	408.550	2.116	10	0		HEAELP
C[NH+](C)[C@@H]1CC[N@H+](Cc2cccnc2)C[C@@H]1CCC(=O)NCC[NH+]1CCCCC1	ZINC000012248075	558362056	/nfs/dbraw/zinc/36/20/56/558362056.db2.gz	DXMYHHUJMPUXED-FCHUYYIVSA-N	3	2	401.599	2.216	10	0		HEAELP
C[NH+](C)[C@@H]1CC[N@@H+](Cc2cccnc2)C[C@@H]1CCC(=O)NCC[NH+]1CCCCC1	ZINC000012248075	558362058	/nfs/dbraw/zinc/36/20/58/558362058.db2.gz	DXMYHHUJMPUXED-FCHUYYIVSA-N	3	2	401.599	2.216	10	0		HEAELP
CCc1[nH]c(CN2CC[C@@H]([NH+]3CCN(c4ccccc4F)CC3)[C@H](O)C2)c(C)[nH+]1	ZINC000011663253	132348727	/nfs/dbraw/zinc/34/87/27/132348727.db2.gz	ONJULAIJJVILDN-NHCUHLMSSA-N	2	2	401.530	2.177	10	0		HEAELP
COC(=O)CC[C@H](C)[NH+]1CCC([NH+]2CCC(C(=O)NCc3cccnc3)CC2)CC1	ZINC000015073569	558714537	/nfs/dbraw/zinc/71/45/37/558714537.db2.gz	AMBPJIRUHGUWLA-SFHVURJKSA-N	2	2	416.566	2.216	10	0		HEAELP
COC(=O)CC[C@@H](C)[NH+]1CCC([NH+]2CCC(C(=O)NCc3cccnc3)CC2)CC1	ZINC000015073568	558714116	/nfs/dbraw/zinc/71/41/16/558714116.db2.gz	AMBPJIRUHGUWLA-GOSISDBHSA-N	2	2	416.566	2.216	10	0		HEAELP
CCOC[C@@H](O)C[NH+]1CCN(c2nc(C)[nH+]c(C)c2Cc2cccc(F)c2)CC1	ZINC000036340187	569141513	/nfs/dbraw/zinc/14/15/13/569141513.db2.gz	WXBBNBNXZFOAAO-FQEVSTJZSA-N	2	2	402.514	2.343	10	0		HEAELP
CCOC[C@H](O)C[NH+]1CCN(c2nc(C)[nH+]c(C)c2Cc2cccc(F)c2)CC1	ZINC000036340186	569141495	/nfs/dbraw/zinc/14/14/95/569141495.db2.gz	WXBBNBNXZFOAAO-HXUWFJFHSA-N	2	2	402.514	2.343	10	0		HEAELP