311948

Source:http://linkedlifedata.com/resource/chembl/compound/311948

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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/C19H18Cl2N2O/c1-14-2-4-15(5-3-14)18(8-10-23-11-9-22-13-23)24-19-7-6-16(20)12-17(19)21/h2-7,9,11-13,18H,8,10H2,1H3
chemicalCompound:standardIn...	PLELFTRFMQYUIS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ccc(cc1)C(CCn2ccnc2)Oc3ccc(Cl)cc3Cl
chemicalCompound:molecularF...	C19H18Cl2N2O
chemicalCompound:moleculeId	311948
chemicalCompound:mwFreebase	361.265
chemicalCompound:alogp	5.044
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	27.05
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.931
chemicalCompound:acdLogD	4.81
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	361.265
chemicalCompound:acdMostBpk...	6.91
chemicalCompound:chemblId	CHEMBL188626
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:411948
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:1463428, activity:1463429, activity:1463430, activity:1463431, activity:1463432, activity:1463535, activity:1463536, activity:1463537, activity:1463538, activity:1463539, activity:2462261, activity:2462262, activity:2462263, activity:2462368, activity:2462369, activity:2462370, activity:2462501, activity:2462502, activity:2463608, activity:2463636, activity:2463705, activity:2463765, activity:2463766, activity:2463830, activity:2463831, activity:2463832