smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CNCc1cc(O)cc2c1C[C@@H]1CCC[C@@H](C1)[C@]13CC[C@H]([C@H]([NH3+])[C@H]1C#CC2)C(C)(C)O3	ZINC000085543158	291250710	/nfs/dbraw/zinc/25/07/10/291250710.db2.gz	VVYKSURRNSOQLI-WRWUNNQCSA-N	1	3	422.613	3.921	1	30	biogenic,in-vitro	HHEFHO
C#CC[N@@H+](CCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCc2ccc(O)cc2C1	ZINC000013438615	581094341	/nfs/dbraw/zinc/09/43/41/581094341.db2.gz	LXFPKJLLIWPMEU-AREMUKBSSA-N	1	3	417.597	3.787	1	30		HHEFHO
C#CC[N@H+](CCCCN1CCN(c2ccccc2)CC1)[C@@H]1CCc2ccc(O)cc2C1	ZINC000013438615	581094342	/nfs/dbraw/zinc/09/43/42/581094342.db2.gz	LXFPKJLLIWPMEU-AREMUKBSSA-N	1	3	417.597	3.787	1	30		HHEFHO
C#CC[N@@H+](CCCCN1CCN(c2ccccc2)CC1)[C@H]1CCc2ccc(O)cc2C1	ZINC000013438618	581094267	/nfs/dbraw/zinc/09/42/67/581094267.db2.gz	LXFPKJLLIWPMEU-SANMLTNESA-N	1	3	417.597	3.787	1	30		HHEFHO
C#CC[N@H+](CCCCN1CCN(c2ccccc2)CC1)[C@H]1CCc2ccc(O)cc2C1	ZINC000013438618	581094268	/nfs/dbraw/zinc/09/42/68/581094268.db2.gz	LXFPKJLLIWPMEU-SANMLTNESA-N	1	3	417.597	3.787	1	30		HHEFHO