575879

Source:http://linkedlifedata.com/resource/chembl/compound/575879

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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/C25H26FN3O6/c1-3-27-14-17(25(32)33)24(31)16-12-18(26)20(13-19(16)27)28-8-10-29(11-9-28)23(30)15-35-22-7-5-4-6-21(22)34-2/h4-7,12-14H,3,8-11,15H2,1-2H3,(H,32,33)
chemicalCompound:standardIn...	XFFUCPCWSGSZNM-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCN1C=C(C(=O)O)C(=O)c2cc(F)c(cc12)N3CCN(CC3)C(=O)COc4ccccc4OC
chemicalCompound:molecularF...	C25H26FN3O6
chemicalCompound:moleculeId	575879
chemicalCompound:mwFreebase	483.489
chemicalCompound:alogp	2.573
chemicalCompound:hba	8
chemicalCompound:hbd	1
chemicalCompound:psa	99.62
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	6.481
chemicalCompound:acdLogP	1.947
chemicalCompound:acdLogD	0.012
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	483.489
chemicalCompound:acdMostBpk...	0.822
chemicalCompound:chemblId	CHEMBL576023
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:675879
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:2999139, activity:2999169, activity:2999199, activity:2999229, activity:2999259, activity:2999289, activity:2999305, activity:2999335