364474

Source:http://linkedlifedata.com/resource/chembl/compound/364474

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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/C35H43N3O2/c1-4-6-8-10-16-22-37-24-28(26-18-12-14-20-30(26)37)32-33(35(40)36(3)34(32)39)29-25-38(23-17-11-9-7-5-2)31-21-15-13-19-27(29)31/h12-15,18-21,24-25H,4-11,16-17,22-23H2,1-3H3
chemicalCompound:standardIn...	FQTRASUGPDYBRO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCn1cc(C2=C(C(=O)N(C)C2=O)c3cn(CCCCCCC)c4ccccc34)c5ccccc15
chemicalCompound:molecularF...	C35 H43 N3 O2
chemicalCompound:moleculeId	364474
chemicalCompound:mwFreebase	537.735
chemicalCompound:alogp	9.162
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	47.24
chemicalCompound:rtb	14
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	10.08
chemicalCompound:acdLogD	10.08
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	537.735
chemicalCompound:chemblId	CHEMBL218785
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:464474
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:1795308, activity:1795323