smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC[N@H+](c1ccc(C[NH3+])cc1)C1CCCCC1	ZINC000034654763	169182199	/nfs/dbraw/zinc/18/21/99/169182199.db2.gz	YZWZNPCDLYKBKQ-UHFFFAOYSA-N	2	2	246.398	3.694	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)C1CCCCC1	ZINC000034654763	169182198	/nfs/dbraw/zinc/18/21/98/169182198.db2.gz	YZWZNPCDLYKBKQ-UHFFFAOYSA-N	2	2	246.398	3.694	20	10		BHCDLP
CCC[N@H+](c1ccc(C[NH3+])cc1)[C@H]1CCC[C@@H]1C	ZINC000775140320	585672561	/nfs/dbraw/zinc/67/25/61/585672561.db2.gz	LWQPOGXILNBCPZ-BBRMVZONSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)[C@H]1CCC[C@@H]1C	ZINC000775140320	585672560	/nfs/dbraw/zinc/67/25/60/585672560.db2.gz	LWQPOGXILNBCPZ-BBRMVZONSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@H+](c1ccc(C[NH3+])cc1)[C@H]1CCC[C@H]1C	ZINC000775140322	585672514	/nfs/dbraw/zinc/67/25/14/585672514.db2.gz	LWQPOGXILNBCPZ-CJNGLKHVSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)[C@H]1CCC[C@H]1C	ZINC000775140322	585672513	/nfs/dbraw/zinc/67/25/13/585672513.db2.gz	LWQPOGXILNBCPZ-CJNGLKHVSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@H+](c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@H]1C	ZINC000775140324	585672566	/nfs/dbraw/zinc/67/25/66/585672566.db2.gz	LWQPOGXILNBCPZ-CZUORRHYSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@H]1C	ZINC000775140324	585672565	/nfs/dbraw/zinc/67/25/65/585672565.db2.gz	LWQPOGXILNBCPZ-CZUORRHYSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@H+](c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@@H]1C	ZINC000775140328	585672676	/nfs/dbraw/zinc/67/26/76/585672676.db2.gz	LWQPOGXILNBCPZ-XJKSGUPXSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@@H]1C	ZINC000775140328	585672675	/nfs/dbraw/zinc/67/26/75/585672675.db2.gz	LWQPOGXILNBCPZ-XJKSGUPXSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@H+](c1ccc(C[NH3+])cc1)[C@H](C)C1CCC1	ZINC000793193953	586013747	/nfs/dbraw/zinc/01/37/47/586013747.db2.gz	YGBBCKZYXKHSOL-CYBMUJFWSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)[C@H](C)C1CCC1	ZINC000793193953	586013746	/nfs/dbraw/zinc/01/37/46/586013746.db2.gz	YGBBCKZYXKHSOL-CYBMUJFWSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@H+](c1ccc(C[NH3+])cc1)[C@@H](C)C1CCC1	ZINC000793193957	586013668	/nfs/dbraw/zinc/01/36/68/586013668.db2.gz	YGBBCKZYXKHSOL-ZDUSSCGKSA-N	2	2	246.398	3.550	20	10		BHCDLP
CCC[N@@H+](c1ccc(C[NH3+])cc1)[C@@H](C)C1CCC1	ZINC000793193957	586013667	/nfs/dbraw/zinc/01/36/67/586013667.db2.gz	YGBBCKZYXKHSOL-ZDUSSCGKSA-N	2	2	246.398	3.550	20	10		BHCDLP