941913

Source:http://linkedlifedata.com/resource/chembl/compound/941913

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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/C17H15N7O4/c1-22-15-13(16(27)23(2)17(22)28)18-8-24(15)7-11(25)20-21-12-9-5-3-4-6-10(9)19-14(12)26/h3-6,8,19,26H,7H2,1-2H3
chemicalCompound:standardIn...	KAZSHVZINQPJLP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN1C(=O)N(C)c2c(ncn2CC(=O)N=Nc3c(O)[nH]c4ccccc34)C1=O
chemicalCompound:molecularF...	C17H15N7O4
chemicalCompound:moleculeId	941913
chemicalCompound:mwFreebase	381.345
chemicalCompound:alogp	1.891
chemicalCompound:hba	7
chemicalCompound:hbd	2
chemicalCompound:psa	136.24
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.296
chemicalCompound:acdLogD	-0.717
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	381.345
chemicalCompound:acdMostBpk...	9.565
chemicalCompound:chemblId	CHEMBL1518029
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1041913
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:3809605, activity:4144617, activity:4327321, activity:4623550, activity:4738877, activity:5015691, activity:5932569, activity:7138669