273646

Source:http://linkedlifedata.com/resource/chembl/compound/273646

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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/C18H17Cl2NO4/c1-18(2,17(23)24)25-15-5-3-11(4-6-15)7-16(22)21-14-9-12(19)8-13(20)10-14/h3-6,8-10H,7H2,1-2H3,(H,21,22)(H,23,24)
chemicalCompound:standardIn...	YSKMQAIZJHNDTP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)(Oc1ccc(CC(=O)Nc2cc(Cl)cc(Cl)c2)cc1)C(=O)O
chemicalCompound:molecularF...	C18 H17 Cl2 N O4
chemicalCompound:moleculeId	273646
chemicalCompound:mwFreebase	382.238
chemicalCompound:alogp	4.239
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	75.63
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.258
chemicalCompound:acdLogP	3.788
chemicalCompound:acdLogD	0.18
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	382.238
chemicalCompound:chemblId	CHEMBL166273
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:373646
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:179833, activity:291529, activity:291530, activity:291531, activity:291532, activity:291533, activity:291534, activity:291535, activity:291536, activity:291537, activity:291538, activity:291539, activity:291540, activity:291541, activity:291542, activity:291543