1216275

Source:http://linkedlifedata.com/resource/chembl/compound/1216275

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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/C25H30N6O3/c1-17-24(28(4)15-20-5-8-22(9-6-20)27-18(2)32)31-16-21(7-10-23(31)26-17)25(34)30-13-11-29(12-14-30)19(3)33/h5-10,16H,11-15H2,1-4H3,(H,27,32)
chemicalCompound:standardIn...	HXZJZQOKLJXGNH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(Cc1ccc(NC(=O)C)cc1)c2c(C)nc3ccc(cn23)C(=O)N4CCN(CC4)C(=O)C
chemicalCompound:molecularF...	C25H30N6O3
chemicalCompound:moleculeId	1216275
chemicalCompound:mwFreebase	462.544
chemicalCompound:alogp	0.889
chemicalCompound:hba	5
chemicalCompound:hbd	1
chemicalCompound:psa	90.26
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.968
chemicalCompound:acdLogD	0
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	462.544
chemicalCompound:acdMostBpk...	8.322
chemicalCompound:chemblId	CHEMBL1875704
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1316275
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:7005794