1230606

Source:http://linkedlifedata.com/resource/chembl/compound/1230606

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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/C24H26N4O4/c1-23(2)11-18(29)20-19(12-23)32-21(26)16(13-25)24(20)15-5-3-4-6-17(15)28(22(24)30)14-27-7-9-31-10-8-27/h3-6H,7-12,14,26H2,1-2H3/t24-/m0/s1
chemicalCompound:standardIn...	WNDDWIBUWGMRQW-DEOSSOPVSA-N
chemicalCompound:canonicalS...	CC1(C)CC(=O)C2=C(C1)OC(=C(C#N)[C@]23C(=O)N(CN4CCOCC4)c5ccccc35)N
chemicalCompound:molecularF...	C24H26N4O4
chemicalCompound:moleculeId	1230606
chemicalCompound:mwFreebase	434.488
chemicalCompound:alogp	1
chemicalCompound:hba	7
chemicalCompound:hbd	1
chemicalCompound:psa	108.89
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	1.615
chemicalCompound:acdLogD	1.614
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	434.488
chemicalCompound:acdMostBpk...	4.89
chemicalCompound:chemblId	CHEMBL1890035
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1330606
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:7538394