508143

Source:http://linkedlifedata.com/resource/chembl/compound/508143

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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/C20H32O2/c1-15-7-6-8-16(2)13-19(21)14-17(3)10-12-18(11-9-15)20(4,5)22/h9,11,13,17,22H,6-8,10,12,14H2,1-5H3/b15-9+,16-13-,18-11+/t17-/m0/s1
chemicalCompound:standardIn...	GHADJBJUJGZEFC-SFUXFWDLSA-N
chemicalCompound:canonicalS...	C[C@H]1CC\C(=C/C=C(\C)/CCC\C(=C/C(=O)C1)\C)\C(C)(C)O
chemicalCompound:molecularF...	C20H32O2
chemicalCompound:moleculeId	508143
chemicalCompound:mwFreebase	304.467
chemicalCompound:alogp	5.134
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.29
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.763
chemicalCompound:acdLogD	4.763
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	304.467
chemicalCompound:chemblId	CHEMBL483895
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:608143
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	GRANDILOBATIN E
chemicalCompound:activity	activity:2460219, activity:2460223, activity:2460227, activity:2460231