1315795

Source:http://linkedlifedata.com/resource/chembl/compound/1315795

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:1329015
chemicalCompound:standardIn...	InChI=1S/C8H12N5O.ClH/c1-12-4-13(2)6-5(12)7(14-3)11-8(9)10-6;/h4H,1-3H3,(H2,9,10,11);1H/q+1;/p-1
chemicalCompound:standardIn...	UUXQFBYNAZATHJ-UHFFFAOYSA-M
chemicalCompound:canonicalS...	[Cl-].COc1nc(N)nc2c1n(C)c[n+]2C
chemicalCompound:molecularF...	C8H12ClN5O
chemicalCompound:moleculeId	1315795
chemicalCompound:mwFreebase	194.214
chemicalCompound:alogp	1.474
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	69.84
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-2.999
chemicalCompound:acdLogD	-2.999
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	229.667
chemicalCompound:acdMostBpk...	1
chemicalCompound:chemblId	CHEMBL1994504
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1415795
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:8231314, activity:8241718, activity:8301729, activity:8362706, activity:8396468, activity:8460535, activity:8484984, activity:8545535, activity:8569987, activity:8634861, activity:8646527, activity:8715484, activity:8717724, activity:8755481, activity:8766896, activity:8852893, activity:8859726, activity:8890763, activity:8958678, activity:8995794, activity:9059165, activity:9062250, activity:9084789, activity:9175618, activity:9277162, activity:9283884, activity:9347941, activity:9417643, activity:9420239, activity:9503252, activity:9509920, activity:9671447, activity:9708124, activity:9775671, activity:9854996, activity:9884035, activity:9922051, activity:10025229, activity:10025290, activity:10068677, activity:10140126, activity:10155554, activity:10246172, activity:10270388, activity:10272863, activity:10364945, activity:10392623, activity:10434824, activity:10458212, activity:10486071, activity:10583359, activity:10665591, activity:10667931, activity:10692156, activity:10765384, activity:10789482