1175628

Source:http://linkedlifedata.com/resource/chembl/compound/1175628

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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/C15H19NO3/c1-11(2)6-4-7-12(3)10-14-18-15(16-19-14)13-8-5-9-17-13/h5-6,8-10,14H,4,7H2,1-3H3/b12-10+
chemicalCompound:standardIn...	HQCSKLJPGBMBJU-ZRDIBKRKSA-N
chemicalCompound:canonicalS...	CC(=CCC\C(=C\C1ON=C(O1)c2occc2)\C)C
chemicalCompound:molecularF...	C15H19NO3
chemicalCompound:moleculeId	1175628
chemicalCompound:mwFreebase	261.316
chemicalCompound:alogp	4.497
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	43.96
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	4.496
chemicalCompound:acdLogD	4.496
chemicalCompound:fullMwt	261.316
chemicalCompound:chemblId	CHEMBL1828937
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1275628
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:6364329, activity:6364352, activity:6364408