smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N@H+](C)c1ccc(OC)cc1	5139248	571836183	/nfs/dbraw/zinc/83/61/83/571836183.db2.gz	WBETYEFPZHEIDA-UHFFFAOYSA-N	1	2	165.236	2.151	20	10		AECDLO
CC[N@@H+](C)c1ccc(OC)cc1	5139248	571836186	/nfs/dbraw/zinc/83/61/86/571836186.db2.gz	WBETYEFPZHEIDA-UHFFFAOYSA-N	1	2	165.236	2.151	20	10		AECDLO
C[N@H+](CCCF)c1ccc(N)cc1	88025680	572932006	/nfs/dbraw/zinc/93/20/06/572932006.db2.gz	NQFUBRXPGLVMEG-UHFFFAOYSA-N	1	2	182.242	2.065	20	10		AECDLO
C[N@@H+](CCCF)c1ccc(N)cc1	88025680	572932009	/nfs/dbraw/zinc/93/20/09/572932009.db2.gz	NQFUBRXPGLVMEG-UHFFFAOYSA-N	1	2	182.242	2.065	20	10		AECDLO
[NH3+]Cc1ccc(Cl)c(Cl)c1O	82636703	169222536	/nfs/dbraw/zinc/22/25/36/169222536.db2.gz	JYNFZSKJUPJJEO-UHFFFAOYSA-N	1	2	192.045	2.158	20	10		AECDLO
C[C@@H]([NH3+])c1cc(F)cc(Cl)c1O	95718376	630206097	/nfs/dbraw/zinc/20/60/97/630206097.db2.gz	UVXUFPLCUZBOSL-SCSAIBSYSA-N	1	2	189.617	2.204	20	10		AECDLO
C[C@H]([NH3+])c1cc(F)cc(Cl)c1O	95714691	631162080	/nfs/dbraw/zinc/16/20/80/631162080.db2.gz	UVXUFPLCUZBOSL-BYPYZUCNSA-N	1	2	189.617	2.204	20	10		AECDLO