369183

Source:http://linkedlifedata.com/resource/chembl/compound/369183

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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/C15H8F6N2O2/c16-14(17,18)7-1-3-10-9(5-7)22-13(25)23(10)11-6-8(15(19,20)21)2-4-12(11)24/h1-6,24H,(H,22,25)
chemicalCompound:standardIn...	YLFMCMWKHSDUCT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1ccc(cc1N2C(=O)Nc3cc(ccc23)C(F)(F)F)C(F)(F)F
chemicalCompound:molecularF...	C15H8F6N2O2
chemicalCompound:moleculeId	369183
chemicalCompound:mwFreebase	362.227
chemicalCompound:alogp	4.117
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	52.57
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.317
chemicalCompound:acdLogP	3.568
chemicalCompound:acdLogD	3.532
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	362.227
chemicalCompound:chemblId	CHEMBL384903
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:469183
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:366200, activity:1817341, activity:2205855, activity:2205856, activity:2228539, activity:2262536, activity:2351471, activity:2506546, activity:2618244, activity:2618263, activity:3473181, activity:3487100, activity:3487101, activity:3487102, activity:3487103, activity:3487104, activity:3487105, activity:3487106, activity:3636065, activity:3672738, activity:3696334, activity:3793323, activity:3806683, activity:3897334, activity:3940055, activity:3971278, activity:3974117, activity:4014515, activity:4028050, activity:4069621, activity:4255885, activity:4279424, activity:4358452, activity:4448282, activity:4502544, activity:4536195, activity:4539025, activity:4568273, activity:4586019, activity:4672810, activity:4750058, activity:4901225, activity:4941814, activity:4970524, activity:5002218, activity:5037420, activity:5070832, activity:5332257, activity:5507880, activity:5779079, activity:5785660, activity:5802508, activity:5856635, activity:5867216, activity:5875914, activity:5978817, activity:6003400, activity:6007107, activity:6058463, activity:6065079, activity:6066004, activity:6276968, activity:6277586, activity:6441255, activity:6575590, activity:6787391, activity:7075644