247401

Source:http://linkedlifedata.com/resource/chembl/compound/247401

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:247401_Ansolysen_OTHER, synonym:247401_Pentolinium_FDA_ALTERNATIVE_NAME
chemicalCompound:standardIn...	InChI=1S/C15H32N2/c1-16(12-6-7-13-16)10-4-3-5-11-17(2)14-8-9-15-17/h3-15H2,1-2H3/q+2
chemicalCompound:standardIn...	XSBSKEQEUFOSDD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C[N+]1(CCCCC[N+]2(C)CCCC2)CCCC1
chemicalCompound:molecularF...	C15 H32 N2
chemicalCompound:moleculeId	247401
chemicalCompound:mwFreebase	240.428
chemicalCompound:alogp	-0.231
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-4.191
chemicalCompound:acdLogD	-4.191
chemicalCompound:fullMwt	240.428
chemicalCompound:chemblId	CHEMBL1271
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:347401
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	PENTOLINIUM
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:347401
chemicalCompound:activity	activity:667287