656160

Source:http://linkedlifedata.com/resource/chembl/compound/656160

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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/C27H42NO2/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23/h8-16H,17-22H2,1-7H3/q+1
chemicalCompound:standardIn...	SIYLLGKDQZGJHK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1
chemicalCompound:molecularF...	C27H42NO2
chemicalCompound:moleculeId	656160
chemicalCompound:mwFreebase	412.628
chemicalCompound:alogp	4.82
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	18.46
chemicalCompound:rtb	12
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.002
chemicalCompound:acdLogD	3.002
chemicalCompound:fullMwt	412.628
chemicalCompound:chemblId	CHEMBL1182210
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:756160
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:3643454, activity:3914476, activity:4091140, activity:4125754, activity:4373406, activity:4477444, activity:4519963, activity:4698949, activity:4978982, activity:4994236, activity:5033189, activity:5859310, activity:5988711, activity:5989891, activity:6014830, activity:6018049, activity:6021364, activity:6509241, activity:7114560, activity:7546207, activity:7549687, activity:9000136, activity:9333897, activity:10293666