579535

Source:http://linkedlifedata.com/resource/chembl/compound/579535

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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/C23H29NO3/c1-22(2)21(23(22,3)4)20(26)17-14-24(18-8-6-5-7-16(17)18)19(25)13-15-9-11-27-12-10-15/h5-8,14-15,21H,9-13H2,1-4H3
chemicalCompound:standardIn...	AQPCQPVLFFQSHP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1(C)C(C(=O)c2cn(C(=O)CC3CCOCC3)c4ccccc24)C1(C)C
chemicalCompound:molecularF...	C23H29NO3
chemicalCompound:moleculeId	579535
chemicalCompound:mwFreebase	367.481
chemicalCompound:alogp	4.129
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	48.3
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.585
chemicalCompound:acdLogD	4.585
chemicalCompound:fullMwt	367.481
chemicalCompound:chemblId	CHEMBL570455
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:679535
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:2980434, activity:2980504, activity:2980574, activity:2980643