706055

Source:http://linkedlifedata.com/resource/chembl/compound/706055

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12?,13-,14+,15+,16+,18+,19+/m1/s1
chemicalCompound:standardIn...	QGXBDMJGAMFCBF-YROQGIJISA-N
chemicalCompound:canonicalS...	C[C@]12CC[C@@H](O)CC1CC[C@@H]3[C@@H]2CC[C@@]4(C)[C@H]3CCC4=O
chemicalCompound:molecularF...	C19H30O2
chemicalCompound:moleculeId	706055
chemicalCompound:mwFreebase	290.44
chemicalCompound:alogp	3.588
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.29
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.932
chemicalCompound:acdLogD	3.932
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	290.44
chemicalCompound:chemblId	CHEMBL1257060
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:806055
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:3897269, activity:3989095, activity:4278765, activity:4358553, activity:4403328, activity:4452664, activity:4536062, activity:4538386, activity:4579551, activity:4970410, activity:5029316, activity:6730638, activity:6789874, activity:7005087, activity:7516477