1293018

Source:http://linkedlifedata.com/resource/chembl/compound/1293018

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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/C19H19N3O/c1-12-8-13(2)19-17(9-12)18(10-14(3)21-19)22-20-11-15-4-6-16(23)7-5-15/h4-11,23H,1-3H3,(H,21,22)/b20-11+
chemicalCompound:standardIn...	MDMUKNRLKSHWEN-RGVLZGJSSA-N
chemicalCompound:canonicalS...	Cc1cc(C)c2nc(C)cc(N\N=C\c3ccc(O)cc3)c2c1
chemicalCompound:molecularF...	C19H19N3O
chemicalCompound:moleculeId	1293018
chemicalCompound:mwFreebase	305.374
chemicalCompound:alogp	4.648
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	57.51
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.31
chemicalCompound:acdLogP	5.865
chemicalCompound:acdLogD	4.71
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	305.374
chemicalCompound:acdMostBpk...	0.11
chemicalCompound:chemblId	CHEMBL1971727
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1393018
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:3617973, activity:3792592, activity:3817580, activity:3952490, activity:4088365, activity:4255584, activity:4353364, activity:4385631, activity:4575640, activity:4631584, activity:4680580, activity:4705741, activity:4771426, activity:4811288, activity:4847660, activity:4895490, activity:4933791, activity:4996812, activity:5011983, activity:5020335, activity:5043322, activity:5374055, activity:5405347, activity:5566044, activity:5580724, activity:5654459, activity:5657454, activity:5701352, activity:5795078, activity:5856925, activity:5861134, activity:5878819, activity:6454809, activity:6747046, activity:6767680, activity:6849727, activity:6869075, activity:7007794, activity:7040600, activity:7049041, activity:7162382, activity:7276146, activity:7330501, activity:7373638, activity:7443421, activity:7509153, activity:9816730