1308721

Source:http://linkedlifedata.com/resource/chembl/compound/1308721

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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/C19H17F3N4O/c1-2-4-12-7-8-14-13(11-12)15(9-10-23-14)24-18(27)26-17-6-3-5-16(25-17)19(20,21)22/h3,5-11H,2,4H2,1H3,(H2,23,24,25,26,27)
chemicalCompound:standardIn...	CJJKTILOCMYOOH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCc1ccc2nccc(NC(=O)Nc3cccc(n3)C(F)(F)F)c2c1
chemicalCompound:molecularF...	C19H17F3N4O
chemicalCompound:moleculeId	1308721
chemicalCompound:mwFreebase	374.36
chemicalCompound:alogp	4.867
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	66.91
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.929
chemicalCompound:acdLogP	4.803
chemicalCompound:acdLogD	4.793
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	374.36
chemicalCompound:acdMostBpk...	6.099
chemicalCompound:chemblId	CHEMBL1987430
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1408721
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:9511288, activity:9511789, activity:9512030, activity:9515114, activity:9519346, activity:9519768, activity:9519948, activity:9520663, activity:9524029, activity:9531945, activity:9532761, activity:9532874, activity:9544547, activity:9544740, activity:9548216, activity:9548263, activity:9560797, activity:9561357, activity:9569162, activity:9570138, activity:9574739, activity:9577100, activity:9577588, activity:9578135, activity:9579562, activity:9583609, activity:9584099, activity:9584182, activity:9584771, activity:9586599, activity:9588078, activity:9589061, activity:9589199, activity:9591955, activity:9593358, activity:9594111, activity:9594388, activity:9595974, activity:9599318, activity:9599888, activity:9601207, activity:9601855, activity:9608209, activity:9617040, activity:9618956, activity:9619892, activity:9620458, activity:9625704, activity:9626979, activity:9627601, activity:9628665, activity:9629829, activity:9630649, activity:9630864, activity:9644411, activity:9648306, activity:9649028, activity:9652861, activity:9653486, activity:9657285, activity:9661616, activity:9665989, activity:9678640, activity:9690227, activity:9694289, activity:9694776