932329

Source:http://linkedlifedata.com/resource/chembl/compound/932329

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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/C21H27N3O2S/c1-3-21(2,20(26)23-16-9-4-5-10-16)24(15-17-11-8-14-27-17)19(25)18-12-6-7-13-22-18/h6-8,11-14,16H,3-5,9-10,15H2,1-2H3,(H,23,26)
chemicalCompound:standardIn...	GENAWVOEGWVITF-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCC(C)(N(Cc1cccs1)C(=O)c2ccccn2)C(=O)NC3CCCC3
chemicalCompound:molecularF...	C21H27N3O2S
chemicalCompound:moleculeId	932329
chemicalCompound:mwFreebase	385.523
chemicalCompound:alogp	3.626
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	90.54
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.264
chemicalCompound:acdLogD	3.264
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	385.523
chemicalCompound:acdMostBpk...	2.072
chemicalCompound:chemblId	CHEMBL1508445
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1032329
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:3755239, activity:5342350, activity:5409668, activity:5499043, activity:5536012, activity:5538358, activity:5563086, activity:5855521, activity:5860943, activity:5863950, activity:5881644, activity:5973749, activity:5976353, activity:6502992, activity:6910199