141

Source:http://linkedlifedata.com/resource/chembl/compound/141

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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/C15H14ClNO4/c1-17-12(7-13(19)20)6-10(8-18)14(17)15(21)9-2-4-11(16)5-3-9/h2-6,18H,7-8H2,1H3,(H,19,20)
chemicalCompound:standardIn...	FBQJXWWENUWXNP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cn1c(CC(=O)O)cc(CO)c1C(=O)c2ccc(Cl)cc2
chemicalCompound:molecularF...	C15 H14 Cl N O4
chemicalCompound:moleculeId	141
chemicalCompound:mwFreebase	307.729
chemicalCompound:alogp	2.841
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	79.53
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	4.153
chemicalCompound:acdLogP	2.2
chemicalCompound:acdLogD	-0.946
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	307.729
chemicalCompound:chemblId	CHEMBL6201
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100141
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:216358, activity:216359, activity:216360, activity:216361, activity:216362