160

Source:http://linkedlifedata.com/resource/chembl/compound/160

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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/C32H45N3O10/c1-9-11-33(12-10-2)32(38)45-20-23-19-34(30(36)21-15-24(39-3)28(43-7)25(16-21)40-4)13-14-35(23)31(37)22-17-26(41-5)29(44-8)27(18-22)42-6/h15-18,23H,9-14,19-20H2,1-8H3
chemicalCompound:standardIn...	HZWQZAAOTLGOMR-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCN(CCC)C(=O)OCC1CN(CCN1C(=O)c2cc(OC)c(OC)c(OC)c2)C(=O)c3cc(OC)c(OC)c(OC)c3
chemicalCompound:molecularF...	C32 H45 N3 O10
chemicalCompound:moleculeId	160
chemicalCompound:mwFreebase	631.714
chemicalCompound:alogp	3.842
chemicalCompound:hba	10
chemicalCompound:hbd	0
chemicalCompound:psa	125.54
chemicalCompound:rtb	15
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.003
chemicalCompound:acdLogD	3.003
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	631.714
chemicalCompound:chemblId	CHEMBL269131
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100160
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:33541, activity:33542, activity:43411, activity:43412, activity:43413, activity:1839876, activity:1839886, activity:1839889