143

Source:http://linkedlifedata.com/resource/chembl/compound/143

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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/C33H37FN2O11/c1-40-25-13-20(14-26(41-2)30(25)44-5)32(38)35-11-12-36(33(39)21-15-27(42-3)31(45-6)28(16-21)43-4)23(17-35)18-47-29(37)19-46-24-9-7-22(34)8-10-24/h7-10,13-16,23H,11-12,17-19H2,1-6H3
chemicalCompound:standardIn...	XHWFWJNBJZSGFU-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1cc(cc(OC)c1OC)C(=O)N2CCN(C(COC(=O)COc3ccc(F)cc3)C2)C(=O)c4cc(OC)c(OC)c(OC)c4
chemicalCompound:molecularF...	C33 H37 F N2 O11
chemicalCompound:moleculeId	143
chemicalCompound:mwFreebase	656.652
chemicalCompound:alogp	3.6
chemicalCompound:hba	11
chemicalCompound:hbd	0
chemicalCompound:psa	131.53
chemicalCompound:rtb	14
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.554
chemicalCompound:acdLogD	2.554
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	656.652
chemicalCompound:chemblId	CHEMBL414696
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100143
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:53347