156648

Source:http://linkedlifedata.com/resource/chembl/compound/156648

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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/C26H24N4O3S/c1-20-10-12-23(13-11-20)34(32,33)29-25-9-3-2-8-24(25)26(31)30(18-21-6-4-14-27-16-21)19-22-7-5-15-28-17-22/h2-17,29H,18-19H2,1H3
chemicalCompound:standardIn...	LOQAGOIRDXRGOZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ccc(cc1)S(=O)(=O)Nc2ccccc2C(=O)N(Cc3cccnc3)Cc4cccnc4
chemicalCompound:molecularF...	C26 H24 N4 O3 S
chemicalCompound:moleculeId	156648
chemicalCompound:mwFreebase	472.559
chemicalCompound:alogp	3.083
chemicalCompound:hba	5
chemicalCompound:hbd	1
chemicalCompound:psa	100.64
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.029
chemicalCompound:acdLogP	2.192
chemicalCompound:acdLogD	2.092
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	472.559
chemicalCompound:acdMostBpk...	4.973
chemicalCompound:chemblId	CHEMBL316494
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:256648
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:319694