13355

Source:http://linkedlifedata.com/resource/chembl/compound/13355

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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:13355_Imidazole_OTHER
chemicalCompound:standardIn...	InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)
chemicalCompound:standardIn...	RAXXELZNTBOGNW-UHFFFAOYSA-N
chemicalCompound:canonicalS...	c1c[nH]cn1
chemicalCompound:molecularF...	C3H4N2
chemicalCompound:moleculeId	13355
chemicalCompound:mwFreebase	68.0773
chemicalCompound:alogp	-0.283
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	28.68
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.89
chemicalCompound:acdLogP	-0.099
chemicalCompound:acdLogD	-0.441
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	68.0773
chemicalCompound:acdMostBpk...	7.18
chemicalCompound:chemblId	CHEMBL540
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:113355
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	IMIDAZOLE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16069
chemicalCompound:activity	activity:55785, activity:102213, activity:102214, activity:102215, activity:102216, activity:271144, activity:336645, activity:336646, activity:336647, activity:596484, activity:659147, activity:1091022, activity:1102951, activity:1183761, activity:2341109, activity:3401931, activity:3401963, activity:3403006, activity:3539294, activity:3539360, activity:3539426, activity:3539492, activity:4057131, activity:4133833