1028973

Source:http://linkedlifedata.com/resource/chembl/compound/1028973

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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/C19H30N2O/c22-18(20-7-6-14-4-2-1-3-5-14)21-19-11-15-8-16(12-19)10-17(9-15)13-19/h4,15-17H,1-3,5-13H2,(H2,20,21,22)
chemicalCompound:standardIn...	FLFUAIGBRVFFNJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	O=C(NCCC1=CCCCC1)NC23CC4CC(CC(C4)C2)C3
chemicalCompound:molecularF...	C19H30N2O
chemicalCompound:moleculeId	1028973
chemicalCompound:mwFreebase	302.454
chemicalCompound:alogp	3.84
chemicalCompound:hba	1
chemicalCompound:hbd	2
chemicalCompound:psa	41.13
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.877
chemicalCompound:acdLogD	4.877
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	302.454
chemicalCompound:chemblId	CHEMBL1605089
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1128973
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:3622362, activity:3739856, activity:3820605, activity:3833026, activity:3895002, activity:4131495, activity:4281553, activity:4393665, activity:4414315, activity:4437269, activity:4467329, activity:4584027, activity:4748205, activity:5011034, activity:5444313, activity:5547362, activity:5593254, activity:5678666, activity:5894545, activity:5979748, activity:6563932, activity:6600399, activity:6966230, activity:7196160, activity:7316221, activity:7402969, activity:7418402