1023393

Source:http://linkedlifedata.com/resource/chembl/compound/1023393

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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/C15H14F2N2S/c16-13-5-1-11(2-6-13)9-18-15(20)19-10-12-3-7-14(17)8-4-12/h1-8H,9-10H2,(H2,18,19,20)
chemicalCompound:standardIn...	SWGWXOVOACUCHI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Fc1ccc(CNC(=NCc2ccc(F)cc2)S)cc1
chemicalCompound:molecularF...	C15H14F2N2S
chemicalCompound:moleculeId	1023393
chemicalCompound:mwFreebase	292.347
chemicalCompound:alogp	4.231
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	63.19
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	3.99
chemicalCompound:acdLogD	1.49
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	292.347
chemicalCompound:acdMostBpk...	14.068
chemicalCompound:chemblId	CHEMBL1599509
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1123393
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:4088393, activity:4814827, activity:5853222, activity:5865821, activity:5973207, activity:6657385, activity:6767843, activity:7166042, activity:7366247