829867

Source:http://linkedlifedata.com/resource/chembl/compound/829867

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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/C25H21FN2O2S/c1-17-11-12-19(15-21(17)26)28-23(29)13-14-31-25(28)20-9-5-6-10-22(20)27(24(25)30)16-18-7-3-2-4-8-18/h2-12,15H,13-14,16H2,1H3
chemicalCompound:standardIn...	FHBGTXJIJNHYKH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ccc(cc1F)N2C(=O)CCSC23C(=O)N(Cc4ccccc4)c5ccccc35
chemicalCompound:molecularF...	C25H21FN2O2S
chemicalCompound:moleculeId	829867
chemicalCompound:mwFreebase	432.51
chemicalCompound:alogp	4.966
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	65.92
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	8.483
chemicalCompound:acdLogD	8.483
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	432.51
chemicalCompound:chemblId	CHEMBL1405983
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:929867
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:4002565, activity:4067991, activity:5357904, activity:5686135, activity:6960404, activity:7306991, activity:9351375, activity:10638456