189294

Source:http://linkedlifedata.com/resource/chembl/compound/189294

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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/C26H38O4/c1-5-6-7-8-11-30-16-25-14-20-18(4)9-10-21(20)24(15-27)13-19(25)12-22(17(2)3)26(24,25)23(28)29/h12,15,17,19,21H,5-11,13-14,16H2,1-4H3,(H,28,29)/t19?,21-,24?,25?,26+/m1/s1
chemicalCompound:standardIn...	ZPSHOKYSYZJMRB-NRBDWONYSA-N
chemicalCompound:canonicalS...	CCCCCCOCC12CC3=C(C)CC[C@H]3C4(CC1C=C(C(C)C)[C@@]24C(=O)O)C=O
chemicalCompound:molecularF...	C26 H38 O4
chemicalCompound:moleculeId	189294
chemicalCompound:mwFreebase	414.578
chemicalCompound:alogp	4.982
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	63.6
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.823
chemicalCompound:acdLogP	4.537
chemicalCompound:acdLogD	1.183
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	414.578
chemicalCompound:chemblId	CHEMBL115101
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:289294
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:1223595, activity:1223596, activity:1223597