292418

Source:http://linkedlifedata.com/resource/chembl/compound/292418

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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/C20H31N5O3S/c1-15(21)19(26)23-12-11-16-7-9-18(10-8-16)29(27,28)25-14-13-24(20(25)22)17-5-3-2-4-6-17/h7-10,15,17,22H,2-6,11-14,21H2,1H3,(H,23,26)
chemicalCompound:standardIn...	XFEFHDGWSJFDBQ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(N)C(=O)NCCc1ccc(cc1)S(=O)(=O)N2CCN(C3CCCCC3)C2=N
chemicalCompound:molecularF...	C20 H31 N5 O3 S
chemicalCompound:moleculeId	292418
chemicalCompound:mwFreebase	421.557
chemicalCompound:alogp	1.635
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	127.96
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1
chemicalCompound:acdLogD	0.412
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	421.557
chemicalCompound:acdMostBpk...	8.261
chemicalCompound:chemblId	CHEMBL368412
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:392418
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:900578, activity:900579, activity:900580