230762

Source:http://linkedlifedata.com/resource/chembl/compound/230762

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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/C14H17NO/c1-15-10-5-11-16-14-9-4-7-12-6-2-3-8-13(12)14/h2-4,6-9,15H,5,10-11H2,1H3
chemicalCompound:standardIn...	ZLTWNSXILLAQPT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CNCCCOc1cccc2ccccc12
chemicalCompound:molecularF...	C14 H17 N O
chemicalCompound:moleculeId	230762
chemicalCompound:mwFreebase	215.291
chemicalCompound:alogp	2.387
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	21.26
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.029
chemicalCompound:acdLogD	0.407
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	215.291
chemicalCompound:acdMostBpk...	10.197
chemicalCompound:chemblId	CHEMBL343324
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:330762
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:655870, activity:655871, activity:7945372