931407

Source:http://linkedlifedata.com/resource/chembl/compound/931407

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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/C20H26N4O2S/c1-14(2)11-13-27-20-21-17-16(18(25)22-19(26)23(17)3)24(20)12-7-10-15-8-5-4-6-9-15/h4-6,8-9,14H,7,10-13H2,1-3H3,(H,22,25,26)
chemicalCompound:standardIn...	MAVQZXGRCVDXQK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)CCSc1nc2N(C)C(=O)NC(=O)c2n1CCCc3ccccc3
chemicalCompound:molecularF...	C20H26N4O2S
chemicalCompound:moleculeId	931407
chemicalCompound:mwFreebase	386.511
chemicalCompound:alogp	4.719
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	92.53
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.487
chemicalCompound:acdLogP	4.7
chemicalCompound:acdLogD	4.696
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	386.511
chemicalCompound:chemblId	CHEMBL1507523
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1031407
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:3780590, activity:3883178, activity:4451311, activity:4800978, activity:4827445, activity:4905289, activity:5440958, activity:5514317, activity:5704739, activity:5801180, activity:5871561, activity:6479454