60

Source:http://linkedlifedata.com/resource/chembl/compound/60

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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/C24H27N5O4/c1-31-17-7-4-16(5-8-17)6-9-22(30)28-10-12-29(13-11-28)24-26-19-15-21(33-3)20(32-2)14-18(19)23(25)27-24/h4-9,14-15H,10-13H2,1-3H3,(H2,25,26,27)/b9-6+
chemicalCompound:standardIn...	SXZDDXORUMVOLG-RMKNXTFCSA-N
chemicalCompound:canonicalS...	COc1ccc(\C=C\C(=O)N2CCN(CC2)c3nc(N)c4cc(OC)c(OC)cc4n3)cc1
chemicalCompound:molecularF...	C24 H27 N5 O4
chemicalCompound:moleculeId	60
chemicalCompound:mwFreebase	449.502
chemicalCompound:alogp	2.543
chemicalCompound:hba	8
chemicalCompound:hbd	1
chemicalCompound:psa	103.04
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	2.652
chemicalCompound:acdLogD	2.598
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	449.502
chemicalCompound:acdMostBpk...	6.524
chemicalCompound:chemblId	CHEMBL6347
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100060
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:331003, activity:331004, activity:556929, activity:556930, activity:556931, activity:556932, activity:556933, activity:556934, activity:556935, activity:556936, activity:556937, activity:556938, activity:556939, activity:556940, activity:556941, activity:556942, activity:556943