652600

Source:http://linkedlifedata.com/resource/chembl/compound/652600

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C15H24N/c1-16(2,3)15(12-8-5-9-13-15)14-10-6-4-7-11-14/h4,6-7,10-11H,5,8-9,12-13H2,1-3H3/q+1
chemicalCompound:standardIn...	ICFVFAICDHWELA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C[N+](C)(C)C1(CCCCC1)c2ccccc2
chemicalCompound:molecularF...	C15H24N
chemicalCompound:moleculeId	652600
chemicalCompound:mwFreebase	218.358
chemicalCompound:alogp	2.263
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-1.087
chemicalCompound:acdLogD	-1.087
chemicalCompound:fullMwt	218.358
chemicalCompound:chemblId	CHEMBL1178650
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:752600
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No