smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC[C@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1[nH+]ccc3ccc(C#N)cc31)CC2	ZINC001164716934	720111866	/nfs/dbraw/zinc/11/18/66/720111866.db2.gz	LSUPMEFNWBXMLN-HSZRJFAPSA-N	2	2	427.552	4.009	20	30		IIEDLP
COC[C@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1[nH+]ccc3ccc(C#N)cc31)CC2	ZINC001164716934	720111871	/nfs/dbraw/zinc/11/18/71/720111871.db2.gz	LSUPMEFNWBXMLN-HSZRJFAPSA-N	2	2	427.552	4.009	20	30		IIEDLP
COC[C@@H]1CC2(C[N@@H+]1Cc1ccccn1)CCN(c1[nH+]ccc3ccc(C#N)cc31)CC2	ZINC001164716935	720112587	/nfs/dbraw/zinc/11/25/87/720112587.db2.gz	LSUPMEFNWBXMLN-QHCPKHFHSA-N	2	2	427.552	4.009	20	30		IIEDLP
COC[C@@H]1CC2(C[N@H+]1Cc1ccccn1)CCN(c1[nH+]ccc3ccc(C#N)cc31)CC2	ZINC001164716935	720112592	/nfs/dbraw/zinc/11/25/92/720112592.db2.gz	LSUPMEFNWBXMLN-QHCPKHFHSA-N	2	2	427.552	4.009	20	30		IIEDLP