654250

Source:http://linkedlifedata.com/resource/chembl/compound/654250

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C38H66N2/c1-7-13-27-39(28-14-8-2,29-15-9-3)33-35-19-23-37(24-20-35)38-25-21-36(22-26-38)34-40(30-16-10-4,31-17-11-5)32-18-12-6/h19-26H,7-18,27-34H2,1-6H3/q+2
chemicalCompound:standardIn...	TZNCPLHPHJMLGF-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCC[N+](CCCC)(CCCC)Cc1ccc(cc1)c2ccc(C[N+](CCCC)(CCCC)CCCC)cc2
chemicalCompound:molecularF...	C38H66N2
chemicalCompound:moleculeId	654250
chemicalCompound:mwFreebase	550.944
chemicalCompound:alogp	8.758
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	23
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-0.52
chemicalCompound:acdLogD	-0.52
chemicalCompound:fullMwt	550.944
chemicalCompound:chemblId	CHEMBL1180300
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:754250
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No