1308252

Source:http://linkedlifedata.com/resource/chembl/compound/1308252

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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/C12H11F7N2O2/c1-2-23-9(22)21-10(11(14,15)16,12(17,18)19)20-8-5-3-4-7(13)6-8/h3-6,20H,2H2,1H3,(H,21,22)
chemicalCompound:standardIn...	KGMLTQCQTSEXKL-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCOC(=O)NC(Nc1cccc(F)c1)(C(F)(F)F)C(F)(F)F
chemicalCompound:molecularF...	C12H11F7N2O2
chemicalCompound:moleculeId	1308252
chemicalCompound:mwFreebase	348.217
chemicalCompound:alogp	4.221
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	50.36
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.147
chemicalCompound:acdLogP	2.092
chemicalCompound:acdLogD	2.021
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	348.217
chemicalCompound:chemblId	CHEMBL1986961
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1408252
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:8278737, activity:8293981, activity:8344000, activity:8363429, activity:8377994, activity:8402550, activity:8464357, activity:8484235, activity:8553511, activity:8569134, activity:8645700, activity:8659722, activity:8701333, activity:8745721, activity:8748282, activity:8838688, activity:8849844, activity:8880831, activity:8901387, activity:8944594, activity:9049106, activity:9052599, activity:9145565, activity:9147759, activity:9161398, activity:9265406, activity:9280656, activity:9334101, activity:9341649, activity:9414876, activity:9498047, activity:9571401, activity:9666485, activity:9754059, activity:9760155, activity:9770651, activity:9865505, activity:9906925, activity:9941241, activity:9969611, activity:10011293, activity:10022637, activity:10059146, activity:10135293, activity:10150088, activity:10190815, activity:10223404, activity:10259095, activity:10300136, activity:10346382, activity:10416949, activity:10453504, activity:10471790, activity:10569719, activity:10645736, activity:10664759, activity:10677955, activity:10698197, activity:10771210