652295

Source:http://linkedlifedata.com/resource/chembl/compound/652295

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C22H24N/c1-23(2,17-9-12-19-10-4-3-5-11-19)18-21-15-8-14-20-13-6-7-16-22(20)21/h3-16H,17-18H2,1-2H3/q+1/b12-9+
chemicalCompound:standardIn...	CUEGWWBJKWSEKE-FMIVXFBMSA-N
chemicalCompound:canonicalS...	C[N+](C)(C\C=C\c1ccccc1)Cc2cccc3ccccc23
chemicalCompound:molecularF...	C22H24N
chemicalCompound:moleculeId	652295
chemicalCompound:mwFreebase	302.433
chemicalCompound:alogp	3.508
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.093
chemicalCompound:acdLogD	1.093
chemicalCompound:fullMwt	302.433
chemicalCompound:chemblId	CHEMBL1178345
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:752295
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No