1287483

Source:http://linkedlifedata.com/resource/chembl/compound/1287483

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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/C22H26N2O3S/c1-15(2)17-6-8-18(9-7-17)23-22-24(21(25)14-28-22)12-11-16-5-10-19(26-3)20(13-16)27-4/h5-10,13,15H,11-12,14H2,1-4H3/b23-22-
chemicalCompound:standardIn...	FTIJOYTWXHTOBT-FCQUAONHSA-N
chemicalCompound:canonicalS...	COc1ccc(CCN2C(=O)CS/C/2=N\c3ccc(cc3)C(C)C)cc1OC
chemicalCompound:molecularF...	C22H26N2O3S
chemicalCompound:moleculeId	1287483
chemicalCompound:mwFreebase	398.518
chemicalCompound:alogp	5.154
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	76.43
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	5.302
chemicalCompound:acdLogD	5.302
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	398.518
chemicalCompound:chemblId	CHEMBL1966192
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1387483
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:3818877, activity:3860307, activity:4087202, activity:4234906, activity:4402274, activity:4745348, activity:4749723, activity:4803111, activity:4905005, activity:4939266, activity:5434808, activity:5499030, activity:5535970, activity:5563073, activity:5585715, activity:5863908, activity:5876306, activity:5976311, activity:6559200, activity:7048880, activity:7143312, activity:7265149, activity:7323050, activity:7533455, activity:8287605, activity:10306538, activity:10672906