30363

Source:http://linkedlifedata.com/resource/chembl/compound/30363

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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/C9H7NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-5,10H,(H,11,12)
chemicalCompound:standardIn...	HCUARRIEZVDMPT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC(=O)c1cc2ccccc2[nH]1
chemicalCompound:molecularF...	C9H7NO2
chemicalCompound:moleculeId	30363
chemicalCompound:mwFreebase	161.157
chemicalCompound:alogp	2.044
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	53.09
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	4.442
chemicalCompound:acdLogP	1.858
chemicalCompound:acdLogD	-0.96
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	161.157
chemicalCompound:chemblId	CHEMBL278390
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:130363
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:935738, activity:966830, activity:966831, activity:966832, activity:985289, activity:985290, activity:1076704, activity:1166454, activity:1166455, activity:1166456, activity:2338123, activity:2338134, activity:2998003, activity:3712576, activity:3745909, activity:4044453, activity:4780819