653931

Source:http://linkedlifedata.com/resource/chembl/compound/653931

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Named Graph Language Inference

Statements in which the resource exists.
Subject	Predicate	Object	Context
chemicalCompound:653931	chemicalCompound:standardIn...	InChI=1S/C21H26N/c1-14-19(13-22(2,3)4)21-17-11-7-5-9-15(17)20(14)16-10-6-8-12-18(16)21/h5-12,14,19-21H,13H2,1-4H3/q+1	lld:chembl
chemicalCompound:653931	chemicalCompound:standardIn...	BYRDVUOMLBWELU-UHFFFAOYSA-N	lld:chembl
chemicalCompound:653931	chemicalCompound:canonicalS...	CC1C(C[N+](C)(C)C)C2c3ccccc3C1c4ccccc24	lld:chembl
chemicalCompound:653931	chemicalCompound:molecularF...	C21H26N	lld:chembl
chemicalCompound:653931	chemicalCompound:moleculeId	653931	lld:chembl
chemicalCompound:653931	chemicalCompound:mwFreebase	292.438	lld:chembl
chemicalCompound:653931	chemicalCompound:alogp	2.749	lld:chembl
chemicalCompound:653931	chemicalCompound:hba	0	lld:chembl
chemicalCompound:653931	chemicalCompound:hbd	0	lld:chembl
chemicalCompound:653931	chemicalCompound:psa	0	lld:chembl
chemicalCompound:653931	chemicalCompound:rtb	2	lld:chembl
chemicalCompound:653931	chemicalCompound:ro3Pass	Y	lld:chembl
chemicalCompound:653931	chemicalCompound:numRo5viol...	0	lld:chembl
chemicalCompound:653931	chemicalCompound:medChemFri...	Y	lld:chembl
chemicalCompound:653931	chemicalCompound:acdLogP	-0.739	lld:chembl
chemicalCompound:653931	chemicalCompound:acdLogD	-0.739	lld:chembl
chemicalCompound:653931	chemicalCompound:fullMwt	292.438	lld:chembl
chemicalCompound:653931	chemicalCompound:chemblId	CHEMBL1179981	lld:chembl
chemicalCompound:653931	chemicalCompound:maxPhase	0	lld:chembl
chemicalCompound:653931	chemicalCompound:therapeuti...	0	lld:chembl
chemicalCompound:653931	chemicalCompound:dosedIngre...	No	lld:chembl
chemicalCompound:653931	chemicalCompound:structureT...	structureType:MOL	lld:chembl
chemicalCompound:653931	chemicalCompound:chebi	https://linkedlifedata.com/...	lld:chembl
chemicalCompound:653931	chemicalCompound:moleculeTy...	moleculeType:Small molecule	lld:chembl
chemicalCompound:653931	chemicalCompound:oral	No	lld:chembl
chemicalCompound:653931	chemicalCompound:parenteral	No	lld:chembl
chemicalCompound:653931	chemicalCompound:topical	No	lld:chembl
chemicalCompound:653931	chemicalCompound:blackBoxWa...	No	lld:chembl
chemicalCompound:653931	chemicalCompound:naturalPro...	No	lld:chembl
chemicalCompound:653931	chemicalCompound:proDrug	No	lld:chembl
chemicalCompound:179433	chemicalCompound:parent	chemicalCompound:653931	lld:chembl