653339

Source:http://linkedlifedata.com/resource/chembl/compound/653339

Download in:

Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:653339	chemicalCompound:standardIn...	InChI=1S/C22H33ClN/c1-2-3-4-5-6-15-24-16-13-20(14-17-24)21(18-24)10-7-19-8-11-22(23)12-9-19/h8-12,20H,2-7,13-18H2,1H3/q+1/b21-10+	lld:chembl
chemicalCompound:653339	chemicalCompound:standardIn...	IIFFZYFXMPWTFJ-UFFVCSGVSA-N	lld:chembl
chemicalCompound:653339	chemicalCompound:canonicalS...	CCCCCCC[N+]12CCC(CC1)\C(=C\Cc3ccc(Cl)cc3)\C2	lld:chembl
chemicalCompound:653339	chemicalCompound:molecularF...	C22H33ClN	lld:chembl
chemicalCompound:653339	chemicalCompound:moleculeId	653339	lld:chembl
chemicalCompound:653339	chemicalCompound:mwFreebase	346.957	lld:chembl
chemicalCompound:653339	chemicalCompound:alogp	5.165	lld:chembl
chemicalCompound:653339	chemicalCompound:hba	0	lld:chembl
chemicalCompound:653339	chemicalCompound:hbd	0	lld:chembl
chemicalCompound:653339	chemicalCompound:psa	0	lld:chembl
chemicalCompound:653339	chemicalCompound:rtb	8	lld:chembl
chemicalCompound:653339	chemicalCompound:ro3Pass	N	lld:chembl
chemicalCompound:653339	chemicalCompound:numRo5viol...	1	lld:chembl
chemicalCompound:653339	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:653339	chemicalCompound:acdLogP	2.081	lld:chembl
chemicalCompound:653339	chemicalCompound:acdLogD	2.081	lld:chembl
chemicalCompound:653339	chemicalCompound:fullMwt	346.957	lld:chembl
chemicalCompound:653339	chemicalCompound:chemblId	CHEMBL1179389	lld:chembl
chemicalCompound:653339	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:653339	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:653339	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:653339	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:653339	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:653339	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:653339	chemicalCompound:oral	No	lld:chembl
chemicalCompound:653339	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:653339	chemicalCompound:topical	No	lld:chembl
chemicalCompound:653339	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:653339	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:653339	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:116252	chemicalCompound:parent	chemicalCompound:653339	lld:chembl