smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1c2c(nc1N1CC[NH+](C)CC1)n(C)c(=O)n(C[C@H](O)C[NH+]1CCN(C)CC1)c2=O	ZINC000022922250	557047672	/nfs/dbraw/zinc/04/76/72/557047672.db2.gz	MLYUKPLUSGDILV-OAHLLOKOSA-N	2	2	434.545	-2.206	40	0		IAABLP
Cn1c2c(nc1N1CC[NH+](C)CC1)n(C)c(=O)n(C[C@H](O)CN1CC[NH+](C)CC1)c2=O	ZINC000022922250	557047665	/nfs/dbraw/zinc/04/76/65/557047665.db2.gz	MLYUKPLUSGDILV-OAHLLOKOSA-N	2	2	434.545	-2.206	40	0		IAABLP
Cn1c2c(nc1N1CC[NH+](C)CC1)n(C)c(=O)n(C[C@@H](O)C[NH+]1CCN(C)CC1)c2=O	ZINC000023477257	557093917	/nfs/dbraw/zinc/09/39/17/557093917.db2.gz	MLYUKPLUSGDILV-HNNXBMFYSA-N	2	2	434.545	-2.206	40	0		IAABLP
Cn1c2c(nc1N1CC[NH+](C)CC1)n(C)c(=O)n(C[C@@H](O)CN1CC[NH+](C)CC1)c2=O	ZINC000023477257	557093912	/nfs/dbraw/zinc/09/39/12/557093912.db2.gz	MLYUKPLUSGDILV-HNNXBMFYSA-N	2	2	434.545	-2.206	40	0		IAABLP
[NH3+]CC(=O)OCN1C(=O)[C@H]2[C@H](C1=O)[C@@H]1[C@H]2[C@H]2C=C[C@@H]1[C@H]1C(=O)N(COC(=O)C[NH3+])C(=O)[C@@H]12	ZINC000073314917	556976879	/nfs/dbraw/zinc/97/68/79/556976879.db2.gz	MERYGHQPWQNRHB-GYKCHUDGSA-N	2	2	446.416	-2.831	40	0		IAABLP