274206

Source:http://linkedlifedata.com/resource/chembl/compound/274206

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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/C19H20ClN3O/c1-23(2)11-10-21-18-15-9-8-14(20)12-16(15)22-19(24)17(18)13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H2,21,22,24)
chemicalCompound:standardIn...	GAWCNEFBSQRVAI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(C)CCNc1c(c(O)nc2cc(Cl)ccc12)c3ccccc3
chemicalCompound:molecularF...	C19 H20 Cl N3 O
chemicalCompound:moleculeId	274206
chemicalCompound:mwFreebase	341.835
chemicalCompound:alogp	4.443
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	48.39
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.123
chemicalCompound:acdLogD	2.397
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	341.835
chemicalCompound:acdMostBpk...	10.624
chemicalCompound:chemblId	CHEMBL167201
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:374206
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:34263, activity:34264, activity:34265, activity:34266