smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc2c3cc(O)ccc3c3c(c2cc1OC)CN1CCC[C@H]1C3	ZINC000072122803	203164233	/nfs/dbraw/zinc/16/42/33/203164233.db2.gz	DSYIHAGYTDJTNX-ZDUSSCGKSA-N	0	3	349.430	4.236	1	5		EIBFHN
COc1cc2c(cc1OC)c1c(O)cccc1c1c2CN2CCC[C@H]2C1	ZINC000072142776	216027859	/nfs/dbraw/zinc/02/78/59/216027859.db2.gz	XEATVZZXKFURFH-ZDUSSCGKSA-N	0	3	349.430	4.236	1	5		EIBFHN
Cc1cc(C)c2c(c1)n(CCCN1CCCC1)c1ccccc1c2=O	ZINC000103275059	219281322	/nfs/dbraw/zinc/28/13/22/219281322.db2.gz	JQMVVELTAKJVQI-UHFFFAOYSA-N	0	3	334.463	4.257	1	5		EIBFHN
COc1cc2c3cc(O)ccc3c3c(c2cc1OC)CN1CCC[C@@H]1C3	ZINC000072124337	216016551	/nfs/dbraw/zinc/01/65/51/216016551.db2.gz	DSYIHAGYTDJTNX-CYBMUJFWSA-N	0	3	349.430	4.236	1	5		EIBFHN
CN1CCC[C@@H]1CCNc1ccc2sc3ccccc3c(=O)c2c1	ZINC000012477116	211391689	/nfs/dbraw/zinc/39/16/89/211391689.db2.gz	UFPSLFRMJFJQLX-OAHLLOKOSA-N	0	3	338.476	4.311	3	5		EIBFHN
O=[N+]([O-])c1ccc(OCC2CCN(Cc3ccc(F)cc3)CC2)cc1	ZINC000013605798	211590668	/nfs/dbraw/zinc/59/06/68/211590668.db2.gz	HTYUTOAGQKZAEN-UHFFFAOYSA-N	0	3	344.386	4.025	1	5		EIBFHN
CN(C)CCNc1nc2c3ccc(O)cc3ccc2c2ccccc21	ZINC000013600436	211587987	/nfs/dbraw/zinc/58/79/87/211587987.db2.gz	JLRRZOYMICHZBO-UHFFFAOYSA-N	0	3	331.419	4.220	1	5		EIBFHN
COc1cc2c3ccc(O)cc3c3c(c2cc1OC)CN1CCC[C@H]1C3	ZINC000072125855	216016157	/nfs/dbraw/zinc/01/61/57/216016157.db2.gz	KPTHFBDKGUGCRU-ZDUSSCGKSA-N	0	3	349.430	4.236	1	5		EIBFHN
COc1cc2c3ccccc3c3c(c2cc1OC)CN1CCC[C@H]1[C@H]3O	ZINC000066259868	215029119	/nfs/dbraw/zinc/02/91/19/215029119.db2.gz	ANQNMLURNXPSDY-PGRDOPGGSA-N	0	3	349.430	4.022	1	5		EIBFHN
COc1cc2c3ccccc3c3c(c2cc1OC)CN1CCC[C@@H]1[C@@H]3O	ZINC000066259903	215028994	/nfs/dbraw/zinc/02/89/94/215028994.db2.gz	ANQNMLURNXPSDY-GCJKJVERSA-N	0	3	349.430	4.022	1	5		EIBFHN
CN1CCC[C@H]1CCNc1ccc2sc3ccccc3c(=O)c2c1	ZINC000012477121	211392017	/nfs/dbraw/zinc/39/20/17/211392017.db2.gz	UFPSLFRMJFJQLX-HNNXBMFYSA-N	0	3	338.476	4.311	3	5		EIBFHN