265692

Source:http://linkedlifedata.com/resource/chembl/compound/265692

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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/C23H27N3O2S/c1-28-17-22(27)26(23-24-20-9-5-6-10-21(20)29-23)19-12-15-25(16-13-19)14-11-18-7-3-2-4-8-18/h2-10,19H,11-17H2,1H3
chemicalCompound:standardIn...	UOVMGWXSUKXNEM-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COCC(=O)N(C1CCN(CCc2ccccc2)CC1)c3nc4ccccc4s3
chemicalCompound:molecularF...	C23 H27 N3 O2 S
chemicalCompound:moleculeId	265692
chemicalCompound:mwFreebase	409.544
chemicalCompound:alogp	3.533
chemicalCompound:hba	4
chemicalCompound:hbd	0
chemicalCompound:psa	73.91
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.13
chemicalCompound:acdLogD	0.88
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	409.544
chemicalCompound:acdMostBpk...	8.654
chemicalCompound:chemblId	CHEMBL158971
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:365692
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:50017, activity:50018, activity:50019, activity:50020, activity:50021, activity:50022, activity:50023