675017

Source:http://linkedlifedata.com/resource/chembl/compound/675017

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:27278
chemicalCompound:synonym	synonym:675017_Venlafaxine Hydrochloride_USAN, synonym:675017_Venlafaxine_BAN, synonym:675017_Venlafaxine_INN, synonym:675017_WY-45030_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C17H27NO2.ClH/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14;/h7-10,16,19H,4-6,11-13H2,1-3H3;1H
chemicalCompound:standardIn...	QYRYFNHXARDNFZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.COc1ccc(cc1)C(CN(C)C)C2(O)CCCCC2
chemicalCompound:molecularF...	C17H28ClNO2
chemicalCompound:moleculeId	675017
chemicalCompound:mwFreebase	277.402
chemicalCompound:alogp	3.022
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	32.7
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.475
chemicalCompound:acdLogD	0.757
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	313.863
chemicalCompound:acdMostBpk...	9.265
chemicalCompound:chemblId	CHEMBL1201066
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:775017
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	VENLAFAXINE HYDROCHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:9944
chemicalCompound:firstAppro...	1993
chemicalCompound:activity	activity:5479569