1016044

Source:http://linkedlifedata.com/resource/chembl/compound/1016044

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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/C16H14ClNO2/c1-20-15-4-2-3-14(11-15)18-16(19)10-7-12-5-8-13(17)9-6-12/h2-11H,1H3,(H,18,19)/b10-7-
chemicalCompound:standardIn...	RYAMDQKWNKKFHD-YFHOEESVSA-N
chemicalCompound:canonicalS...	COc1cccc(NC(=O)\C=C/c2ccc(Cl)cc2)c1
chemicalCompound:molecularF...	C16H14ClNO2
chemicalCompound:moleculeId	1016044
chemicalCompound:mwFreebase	287.741
chemicalCompound:alogp	3.73
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	38.33
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	12.565
chemicalCompound:acdLogP	4.165
chemicalCompound:acdLogD	4.165
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	287.741
chemicalCompound:acdMostBpk...	0.081
chemicalCompound:chemblId	CHEMBL1592160
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1116044
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:3774014, activity:3923579, activity:3952238, activity:3956052, activity:4020167, activity:4126047, activity:4413678, activity:4513231, activity:4524578, activity:4541353, activity:4618722, activity:4861867, activity:4973402, activity:5038627, activity:5053559, activity:5069161, activity:7562757