252425

Source:http://linkedlifedata.com/resource/chembl/compound/252425

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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/C9H15ClN2O2/c1-2-7(9(11)14)12-5-6(4-10)3-8(12)13/h6-7H,2-5H2,1H3,(H2,11,14)/t6-,7-/m0/s1
chemicalCompound:standardIn...	PEJPXWBXHQKKNX-BQBZGAKWSA-N
chemicalCompound:canonicalS...	CC[C@H](N1C[C@H](CCl)CC1=O)C(=O)N
chemicalCompound:molecularF...	C9 H15 Cl N2 O2
chemicalCompound:moleculeId	252425
chemicalCompound:mwFreebase	218.681
chemicalCompound:alogp	0
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	63.4
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-0.221
chemicalCompound:acdLogD	-0.221
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	218.681
chemicalCompound:chemblId	CHEMBL358393
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:352425
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:1040132, activity:1040133