126727

Source:http://linkedlifedata.com/resource/chembl/compound/126727

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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/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1
chemicalCompound:standardIn...	ONIBWKKTOPOVIA-SCSAIBSYSA-N
chemicalCompound:canonicalS...	OC(=O)[C@H]1CCCN1
chemicalCompound:molecularF...	C5H9NO2
chemicalCompound:moleculeId	126727
chemicalCompound:mwFreebase	115.13
chemicalCompound:alogp	-2.843
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	49.33
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	2.351
chemicalCompound:acdLogP	-0.06
chemicalCompound:acdLogD	-2.56
chemicalCompound:molecularS...	molecularSpecies:ZWITTERION
chemicalCompound:fullMwt	115.13
chemicalCompound:acdMostBpk...	11.114
chemicalCompound:chemblId	CHEMBL80257
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:226727
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	D-PROLINE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16313
chemicalCompound:activity	activity:1247087, activity:4379772, activity:7928285, activity:7928335