smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc2c(cc1C[N@H+]1CCN(C3CC[NH2+]CC3)C[C@@H](O)C1)OCO2	ZINC000217572227	241261021	/nfs/dbraw/zinc/26/10/21/241261021.db2.gz	NESCAIMGIDMNTP-KRWDZBQOSA-N	2	1	347.459	0.954	50	70		ECIAMP
Cc1ccc(S(=O)(=O)N2CC[NH+](C[C@H]3[C@@H]4C[NH2+]C[C@H]34)CC2)cc1	ZINC000217363968	241247304	/nfs/dbraw/zinc/24/73/04/241247304.db2.gz	QAGIBJFXRSMDMJ-FVQHAEBGSA-N	2	1	335.473	0.767	50	70		ECIAMP
CCCOCC[NH+]1CCN(c2cc(C3CC([NH3+])C3)nc(N)n2)CC1	ZINC000218244768	535234522	/nfs/dbraw/zinc/23/45/22/535234522.db2.gz	WLQJVEXKMPZJSL-UHFFFAOYSA-N	2	1	334.468	0.812	50	70		ECIAMP
C[NH+]1CCC([NH+]2CCC(C(=O)N[C@@H]3CCOC[C@H]3O)CC2)CC1	ZINC000218265910	241311005	/nfs/dbraw/zinc/31/10/05/241311005.db2.gz	UTSZEYGWWUFDEY-HZPDHXFCSA-N	2	1	325.453	0.059	50	70		ECIAMP
CC(C)(C[N@H+]1CCN(c2cc[nH+]cc2)C[C@@H](O)C1)N1CCOCC1	ZINC000217364356	535077511	/nfs/dbraw/zinc/07/75/11/535077511.db2.gz	OXZWUOUDHGQOBX-KRWDZBQOSA-N	2	1	334.464	0.675	50	70		ECIAMP
Cc1cc(N2CCN(C(=O)CN3CCC[N@H+](C)CC3)CC2)cc(C)[nH+]1	ZINC000218623235	241334070	/nfs/dbraw/zinc/33/40/70/241334070.db2.gz	ZJPLVBSWVPLQQG-UHFFFAOYSA-N	2	1	345.491	0.985	50	70		ECIAMP