smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+]CCC[C@@H]([NH3+])c1c(O)cc(Cl)cc1Cl	ZINC000575439640	387126563	/nfs/dbraw/zinc/12/65/63/387126563.db2.gz	SQSJHGODMTXYIS-MRVPVSSYSA-N	2	1	249.141	2.438	10	10		BECEMP
CC[N@H+]1CC[C@@H](C[NH2+]Cc2cc(C)ccc2O)C1	ZINC000071407994	170008576	/nfs/dbraw/zinc/00/85/76/170008576.db2.gz	RDQSHGPJULTWTJ-ZDUSSCGKSA-N	2	1	248.370	2.132	10	10		BECEMP
C[C@@H](c1ccc(N(C)C)cc1)[N@H+]1CC[C@H](C[NH3+])C1	ZINC000050245027	176015256	/nfs/dbraw/zinc/01/52/56/176015256.db2.gz	CZWWUIPHCFRUGS-QWHCGFSZSA-N	2	1	247.386	2.094	10	10		BECEMP
C[C@H]1CCC[N@H+]1[C@@H](CN)c1ccc(N(C)C)cc1	ZINC000037910262	177111579	/nfs/dbraw/zinc/11/15/79/177111579.db2.gz	STYIDRPZDOTZHU-WFASDCNBSA-N	2	1	247.386	2.237	10	10		BECEMP
C[C@H]1CCCN1[C@@H](C[NH3+])c1ccc(N(C)C)cc1	ZINC000037910262	177111581	/nfs/dbraw/zinc/11/15/81/177111581.db2.gz	STYIDRPZDOTZHU-WFASDCNBSA-N	2	1	247.386	2.237	10	10		BECEMP
C[C@H](c1ccc(N(C)C)cc1)[N@@H+]1CCC[NH2+]CC1	ZINC000038087088	177034707	/nfs/dbraw/zinc/03/47/07/177034707.db2.gz	RWWAAOISEMNFFF-CYBMUJFWSA-N	2	1	247.386	2.109	10	10		BECEMP
C[C@H](c1ccc(N(C)C)cc1)[N@H+]1CCC[NH2+]CC1	ZINC000038087088	177034710	/nfs/dbraw/zinc/03/47/10/177034710.db2.gz	RWWAAOISEMNFFF-CYBMUJFWSA-N	2	1	247.386	2.109	10	10		BECEMP
Oc1ccccc1C[NH2+][C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000112017235	588780213	/nfs/dbraw/zinc/78/02/13/588780213.db2.gz	HRFGCPQFMNVOTH-UONOGXRCSA-N	2	1	246.354	2.109	10	10		BECEMP
Cc1ccc(O)c(C[NH+](C)C[C@@H]2CC[N@H+](C)C2)c1	ZINC000156017509	385429050	/nfs/dbraw/zinc/42/90/50/385429050.db2.gz	MFYNENXEZGIUQM-CYBMUJFWSA-N	2	1	248.370	2.084	10	10		BECEMP
Cc1ccc(O)c(C[NH+](C)C[C@@H]2CC[N@@H+](C)C2)c1	ZINC000156017509	385429058	/nfs/dbraw/zinc/42/90/58/385429058.db2.gz	MFYNENXEZGIUQM-CYBMUJFWSA-N	2	1	248.370	2.084	10	10		BECEMP
Oc1ccccc1C[NH2+][C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000112017231	588780417	/nfs/dbraw/zinc/78/04/17/588780417.db2.gz	HRFGCPQFMNVOTH-ZIAGYGMSSA-N	2	1	246.354	2.109	10	10		BECEMP
Cc1ccc(O)c(C[N@H+](C)[C@H]2CCC[NH2+]CC2)c1	ZINC000231456063	641174691	/nfs/dbraw/zinc/17/46/91/641174691.db2.gz	ZSYPZXFQKVYYJL-AWEZNQCLSA-N	2	1	248.370	2.275	10	10		BECEMP
C[C@@H](c1ccc(N(C)C)cc1)[N@@H+]1CCC[NH2+]CC1	ZINC000038087087	176015105	/nfs/dbraw/zinc/01/51/05/176015105.db2.gz	RWWAAOISEMNFFF-ZDUSSCGKSA-N	2	1	247.386	2.109	10	10		BECEMP
C[C@@H](c1ccc(N(C)C)cc1)[N@H+]1CCC[NH2+]CC1	ZINC000038087087	176015108	/nfs/dbraw/zinc/01/51/08/176015108.db2.gz	RWWAAOISEMNFFF-ZDUSSCGKSA-N	2	1	247.386	2.109	10	10		BECEMP
Cc1cccc(C[NH+](C)C[C@@H]2CC[N@H+](C)C2)c1O	ZINC000154657975	642173292	/nfs/dbraw/zinc/17/32/92/642173292.db2.gz	GBPWHVAWMATYFW-CYBMUJFWSA-N	2	1	248.370	2.084	10	10		BECEMP
Cc1cccc(C[NH+](C)C[C@@H]2CC[N@@H+](C)C2)c1O	ZINC000154657975	642173297	/nfs/dbraw/zinc/17/32/97/642173297.db2.gz	GBPWHVAWMATYFW-CYBMUJFWSA-N	2	1	248.370	2.084	10	10		BECEMP
Cc1cccc(C[NH+](C)C[C@H]2CC[N@H+](C)C2)c1O	ZINC000154658098	642174161	/nfs/dbraw/zinc/17/41/61/642174161.db2.gz	GBPWHVAWMATYFW-ZDUSSCGKSA-N	2	1	248.370	2.084	10	10		BECEMP
Cc1cccc(C[NH+](C)C[C@H]2CC[N@@H+](C)C2)c1O	ZINC000154658098	642174163	/nfs/dbraw/zinc/17/41/63/642174163.db2.gz	GBPWHVAWMATYFW-ZDUSSCGKSA-N	2	1	248.370	2.084	10	10		BECEMP
[NH3+]CCC[C@H]([NH3+])c1c(O)cc(Cl)cc1Cl	ZINC000575439582	387123816	/nfs/dbraw/zinc/12/38/16/387123816.db2.gz	SQSJHGODMTXYIS-QMMMGPOBSA-N	2	1	249.141	2.438	10	10		BECEMP
C[C@H](c1ccc(N(C)C)cc1)[N@H+]1CC[C@H](C[NH3+])C1	ZINC000050245028	177033661	/nfs/dbraw/zinc/03/36/61/177033661.db2.gz	CZWWUIPHCFRUGS-CHWSQXEVSA-N	2	1	247.386	2.094	10	10		BECEMP
Cc1ccc(O)c(C[N@@H+]2CCCC[C@H]2C[NH3+])c1	ZINC000071409472	643143520	/nfs/dbraw/zinc/14/35/20/643143520.db2.gz	FUDXUVUURRVYFV-ZDUSSCGKSA-N	2	1	234.343	2.014	10	10		BECEMP
Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2C[NH3+])c1	ZINC000071409472	643143524	/nfs/dbraw/zinc/14/35/24/643143524.db2.gz	FUDXUVUURRVYFV-ZDUSSCGKSA-N	2	1	234.343	2.014	10	10		BECEMP
CC[N@H+]1CC[C@H](C[NH2+]Cc2cc(C)ccc2O)C1	ZINC000071407992	170015073	/nfs/dbraw/zinc/01/50/73/170015073.db2.gz	RDQSHGPJULTWTJ-CYBMUJFWSA-N	2	1	248.370	2.132	10	10		BECEMP
C[C@H](c1ccccc1O)[N@H+]1C[C@@H](C)[C@](C)(C[NH3+])C1	ZINC000310989615	634195160	/nfs/dbraw/zinc/19/51/60/634195160.db2.gz	HMPFHCDUWRRHGY-LALPHHSUSA-N	2	1	248.370	2.370	10	10		BECEMP
C[N@@H+]1[C@@H]2CC[C@H]1CC([NH2+]Cc1ccccc1O)C2	ZINC000076690961	173206607	/nfs/dbraw/zinc/20/66/07/173206607.db2.gz	GQBVFKQVWGUUIJ-AGUYFDCRSA-N	2	1	246.354	2.107	10	10		BECEMP
Cc1ccc(O)c(C[NH+](C)C[C@H]2CC[N@H+](C)C2)c1	ZINC000156017619	385428393	/nfs/dbraw/zinc/42/83/93/385428393.db2.gz	MFYNENXEZGIUQM-ZDUSSCGKSA-N	2	1	248.370	2.084	10	10		BECEMP
Cc1ccc(O)c(C[NH+](C)C[C@H]2CC[N@@H+](C)C2)c1	ZINC000156017619	385428398	/nfs/dbraw/zinc/42/83/98/385428398.db2.gz	MFYNENXEZGIUQM-ZDUSSCGKSA-N	2	1	248.370	2.084	10	10		BECEMP
Cc1ccc(O)c(C[N@H+](C)[C@@H]2CCC[NH2+]CC2)c1	ZINC000231456037	641175741	/nfs/dbraw/zinc/17/57/41/641175741.db2.gz	ZSYPZXFQKVYYJL-CQSZACIVSA-N	2	1	248.370	2.275	10	10		BECEMP
Cc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2C[NH3+])c1	ZINC000071409468	643142914	/nfs/dbraw/zinc/14/29/14/643142914.db2.gz	FUDXUVUURRVYFV-CYBMUJFWSA-N	2	1	234.343	2.014	10	10		BECEMP
Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2C[NH3+])c1	ZINC000071409468	643142921	/nfs/dbraw/zinc/14/29/21/643142921.db2.gz	FUDXUVUURRVYFV-CYBMUJFWSA-N	2	1	234.343	2.014	10	10		BECEMP