675054

Source:http://linkedlifedata.com/resource/chembl/compound/675054

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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:11775
chemicalCompound:synonym	synonym:675054_Methoxamine Hydrochloride_JAN, synonym:675054_Methoxamine_BAN, synonym:675054_Methoxamine_INN
chemicalCompound:standardIn...	InChI=1S/C11H17NO3.ClH/c1-7(12)11(13)9-6-8(14-2)4-5-10(9)15-3;/h4-7,11,13H,12H2,1-3H3;1H
chemicalCompound:standardIn...	YGRFXPCHZBRUKP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.COc1ccc(OC)c(c1)C(O)C(C)N
chemicalCompound:molecularF...	C11H18ClNO3
chemicalCompound:moleculeId	675054
chemicalCompound:mwFreebase	211.258
chemicalCompound:alogp	0.769
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	64.71
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.869
chemicalCompound:acdLogP	0.613
chemicalCompound:acdLogD	-1.097
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	247.719
chemicalCompound:acdMostBpk...	8.291
chemicalCompound:chemblId	CHEMBL1201103
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:775054
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	METHOXAMINE HYDROCHLORIDE
chemicalCompound:activity	activity:3473390, activity:3490145, activity:3631798, activity:3974153, activity:4448958, activity:4545265, activity:4579103, activity:4709531, activity:4753849, activity:4941901, activity:5316194, activity:5316685, activity:5554553, activity:5706111, activity:6635491, activity:7440185, activity:7839448, activity:9347051