8910

Source:http://linkedlifedata.com/resource/chembl/compound/8910

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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:8910_Histamine_FDA_ALTERNATIVE_NAME
chemicalCompound:standardIn...	InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)
chemicalCompound:standardIn...	NTYJJOPFIAHURM-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NCCc1c[nH]cn1
chemicalCompound:molecularF...	C5H9N3
chemicalCompound:moleculeId	8910
chemicalCompound:mwFreebase	111.145
chemicalCompound:alogp	-0.714
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	54.7
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-0.7
chemicalCompound:acdLogD	-2.697
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	111.145
chemicalCompound:acdMostBpk...	9.26
chemicalCompound:chemblId	CHEMBL90
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:108910
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	HISTAMINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:18295
chemicalCompound:activity	activity:138133, activity:138134, activity:138135, activity:158769, activity:158770, activity:158771, activity:158772, activity:168660, activity:168661, activity:168662, activity:190955, activity:190956, activity:190957, activity:190958, activity:190959, activity:190960, activity:190961, activity:190962, activity:190963, activity:196566, activity:196567, activity:196568, activity:196569, activity:199029, activity:199030, activity:199031, activity:199032, activity:218424, activity:218425, activity:218426, activity:218427, activity:218428, activity:218429, activity:218430, activity:218431, activity:218432, activity:218433, activity:218434, activity:221991, activity:221992, activity:221993, activity:221994, activity:221995, activity:221996, activity:221997, activity:221998, activity:221999, activity:222000, activity:222001, activity:239674, activity:239675, activity:239676, activity:244226, activity:244227, activity:244228, activity:244229, activity:244230, activity:244231, activity:244232, activity:277688, activity:277689, activity:277690, activity:277691, activity:277692