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+](CCOC)Cc1oc2ccccc2c1C	ZINC000218580626	567948019	/nfs/dbraw/zinc/94/80/19/567948019.db2.gz	ASIPOTJWEDVSSM-UHFFFAOYSA-N	1	0	261.365	3.600	50	70		CHIARO
C[C@H](C(=O)c1c[nH]c2ccccc12)[NH+]1C[C@H](C)C[C@@H](C)C1	ZINC000217466064	570307947	/nfs/dbraw/zinc/30/79/47/570307947.db2.gz	BMYNOEXNAKSRKS-MGPQQGTHSA-N	1	0	284.403	3.717	50	70		CHIARO
CN(Cc1ccco1)Cc1cnc(C2CCCCC2)nc1	ZINC000218719886	567948058	/nfs/dbraw/zinc/94/80/58/567948058.db2.gz	JTQLRJAGRLWCRP-UHFFFAOYSA-N	1	0	285.391	3.749	50	70		CHIARO
C[C@H](C(=O)c1c[nH]c2ccccc12)[N@@H+]1CCCC[C@@H]1C	ZINC000217466471	570308003	/nfs/dbraw/zinc/30/80/03/570308003.db2.gz	LBVSFXUUSXMYMA-QWHCGFSZSA-N	1	0	270.376	3.614	50	70		CHIARO
C[C@H](C(=O)c1c[nH]c2ccccc12)[N@@H+]1CCCC[C@H]1C	ZINC000217466391	566947978	/nfs/dbraw/zinc/94/79/78/566947978.db2.gz	LBVSFXUUSXMYMA-CHWSQXEVSA-N	1	0	270.376	3.614	50	70		CHIARO
C[C@H](C(=O)c1c[nH]c2ccccc12)[N@H+]1C[C@H](C)C[C@H](C)C1	ZINC000217466164	570307961	/nfs/dbraw/zinc/30/79/61/570307961.db2.gz	BMYNOEXNAKSRKS-HZSPNIEDSA-N	1	0	284.403	3.717	50	70		CHIARO
CN(Cc1ccco1)Cc1cc(C[NH+]2CCCC2)cs1	ZINC000218245651	570308648	/nfs/dbraw/zinc/30/86/48/570308648.db2.gz	OTYZMQKNNVCGSC-UHFFFAOYSA-N	1	0	290.432	3.569	50	70		CHIARO