141305

Source:http://linkedlifedata.com/resource/chembl/compound/141305

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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/C25H25NO4/c1-2-29-24(25(27)28)17-18-11-13-19(14-12-18)30-16-15-26-22-9-5-3-7-20(22)21-8-4-6-10-23(21)26/h3-14,24H,2,15-17H2,1H3,(H,27,28)/t24-/m0/s1
chemicalCompound:standardIn...	WUZIMDSVRIBNNI-DEOSSOPVSA-N
chemicalCompound:canonicalS...	CCO[C@@H](Cc1ccc(OCCn2c3ccccc3c4ccccc24)cc1)C(=O)O
chemicalCompound:molecularF...	C25H25NO4
chemicalCompound:moleculeId	141305
chemicalCompound:mwFreebase	403.47
chemicalCompound:alogp	5.252
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	60.69
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.606
chemicalCompound:acdLogP	4.492
chemicalCompound:acdLogD	1.021
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	403.47
chemicalCompound:chemblId	CHEMBL86658
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:241305
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:315277, activity:315278, activity:315279, activity:315280, activity:315281, activity:977876, activity:977877, activity:977878, activity:977879, activity:977880, activity:977881, activity:977882, activity:977883, activity:977884, activity:977885, activity:977886, activity:977887, activity:977888, activity:977889, activity:977890, activity:977891, activity:977892, activity:977893, activity:977894, activity:977895, activity:977896, activity:977897, activity:977898, activity:977899, activity:1463478, activity:1463479, activity:1463480, activity:1463481, activity:1613064, activity:1613065, activity:1613066