1122122

Source:http://linkedlifedata.com/resource/chembl/compound/1122122

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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/C13H12N4O/c1-17-11-7-10(9-5-3-2-4-6-9)8-14-12(11)15-13(17)16-18/h2-8,18H,1H3,(H,14,15,16)
chemicalCompound:standardIn...	DCVWQAGUQFBCTF-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cn1c(NO)nc2ncc(cc12)c3ccccc3
chemicalCompound:molecularF...	C13H12N4O
chemicalCompound:moleculeId	1122122
chemicalCompound:mwFreebase	240.261
chemicalCompound:alogp	1.799
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	62.97
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.009
chemicalCompound:acdLogD	2.73
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	240.261
chemicalCompound:acdMostBpk...	8.519
chemicalCompound:chemblId	CHEMBL1743302
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1222122
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:6074757, activity:7565116, activity:7565117, activity:7565118, activity:7565119, activity:7565120, activity:7565121, activity:7565122, activity:7565123, activity:7565124, activity:7565125, activity:7565126, activity:7565127, activity:7565128, activity:7565129, activity:7565130, activity:7565131, activity:7565132, activity:7565133, activity:7565134, activity:7565135, activity:7565136, activity:7565137, activity:7565138