1175625

Source:http://linkedlifedata.com/resource/chembl/compound/1175625

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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/C18H21NO4/c1-12(2)5-4-6-13(3)9-17-22-18(19-23-17)14-7-8-15-16(10-14)21-11-20-15/h5,7-10,17H,4,6,11H2,1-3H3/b13-9+
chemicalCompound:standardIn...	HPIXKLMHANEOCO-UKTHLTGXSA-N
chemicalCompound:canonicalS...	CC(=CCC\C(=C\C1ON=C(O1)c2ccc3OCOc3c2)\C)C
chemicalCompound:molecularF...	C18H21NO4
chemicalCompound:moleculeId	1175625
chemicalCompound:mwFreebase	315.364
chemicalCompound:alogp	4.87
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	49.28
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	4.445
chemicalCompound:acdLogD	4.445
chemicalCompound:fullMwt	315.364
chemicalCompound:chemblId	CHEMBL1828934
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1275625
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:6364324, activity:6364349, activity:6364405