1277

Source:http://linkedlifedata.com/resource/chembl/compound/1277

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:1277_BW-A78U_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C13H12FN5/c1-15-12-11-13(17-7-16-12)19(8-18-11)6-9-4-2-3-5-10(9)14/h2-5,7-8H,6H2,1H3,(H,15,16,17)
chemicalCompound:standardIn...	MZABAGHILOTTOD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CNc1ncnc2c1ncn2Cc3ccccc3F
chemicalCompound:molecularF...	C13 H12 F N5
chemicalCompound:moleculeId	1277
chemicalCompound:mwFreebase	257.266
chemicalCompound:alogp	2.108
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	55.63
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.257
chemicalCompound:acdLogD	2.255
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	257.266
chemicalCompound:acdMostBpk...	4.894
chemicalCompound:chemblId	CHEMBL7359
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:101277
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	BW-A78U
chemicalCompound:activity	activity:493357, activity:493358, activity:493359, activity:493360, activity:765859, activity:765860, activity:905764, activity:905765, activity:905766, activity:905767, activity:905768, activity:905769, activity:905770, activity:905771, activity:967516, activity:967517, activity:967518, activity:967519, activity:988597, activity:988598, activity:1129909, activity:1129910, activity:1129911, activity:1129912