485660

Source:http://linkedlifedata.com/resource/chembl/compound/485660

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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/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-14,34-35H,1-2,9-12,15H2,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b26-13-,27-14-
chemicalCompound:standardIn...	BPYKTIZUTYGOLE-IFADSCNNSA-N
chemicalCompound:canonicalS...	CC1=C(C=C)\C(=C\c2[nH]c(Cc3[nH]c(\C=C\4/NC(=O)C(=C4C)C=C)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)\NC1=O
chemicalCompound:molecularF...	C33H36N4O6
chemicalCompound:moleculeId	485660
chemicalCompound:mwFreebase	584.662
chemicalCompound:alogp	5.055
chemicalCompound:hba	6
chemicalCompound:hbd	6
chemicalCompound:psa	164.38
chemicalCompound:rtb	12
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	3
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.621
chemicalCompound:acdLogP	1.43
chemicalCompound:acdLogD	-3.244
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	584.662
chemicalCompound:acdMostBpk...	2.308
chemicalCompound:chemblId	CHEMBL501680
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:585660
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	BILIRUBIN
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16990
chemicalCompound:activity	activity:2194103, activity:2194106, activity:2194109, activity:2194110, activity:2194111, activity:3616859, activity:3666025, activity:3710894, activity:3745776, activity:3763651, activity:3801209, activity:3931251, activity:3962288, activity:3993361, activity:4065939, activity:4181762, activity:4397122, activity:4411911, activity:4529729, activity:4572710, activity:4600017, activity:4839660, activity:5315897, activity:5328773, activity:6073573, activity:6074825, activity:6432375, activity:7063451, activity:7551297, activity:7564545, activity:7564546, activity:7564547, activity:7564548, activity:7564549, activity:7564550, activity:7564551, activity:7564552, activity:7564553, activity:7564554, activity:7564555, activity:7564556, activity:7564557, activity:7564558, activity:7564559, activity:7564560