327595

Source:http://linkedlifedata.com/resource/chembl/compound/327595

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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/C24H29FN4O6/c1-16(30)26-12-21-14-29(24(32)35-21)18-3-6-23(22(25)11-18)28-9-7-27(8-10-28)13-19-4-5-20(34-19)15-33-17(2)31/h3-6,11,21H,7-10,12-15H2,1-2H3,(H,26,30)/t21-/m0/s1
chemicalCompound:standardIn...	DYMANGHXGGBSQX-NRFANRHFSA-N
chemicalCompound:canonicalS...	CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(N3CCN(Cc4oc(COC(=O)C)cc4)CC3)c(F)c2
chemicalCompound:molecularF...	C24 H29 F N4 O6
chemicalCompound:moleculeId	327595
chemicalCompound:mwFreebase	488.509
chemicalCompound:alogp	1.782
chemicalCompound:hba	7
chemicalCompound:hbd	1
chemicalCompound:psa	104.56
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.533
chemicalCompound:acdLogD	0.448
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	488.509
chemicalCompound:acdMostBpk...	6.356
chemicalCompound:chemblId	CHEMBL194247
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:427595
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:1603843, activity:1603844, activity:1603845, activity:1603846, activity:1603847, activity:1603848