25497

Source:http://linkedlifedata.com/resource/chembl/compound/25497

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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:25497_GW-7647_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C29H46N2O3S/c1-29(2,27(32)33)35-26-18-16-24(17-19-26)20-22-31(28(34)30-25-14-7-4-8-15-25)21-10-9-13-23-11-5-3-6-12-23/h16-19,23,25H,3-15,20-22H2,1-2H3,(H,30,34)(H,32,33)
chemicalCompound:standardIn...	PKNYXWMTHFMHKD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)(Sc1ccc(CCN(CCCCC2CCCCC2)C(=O)NC3CCCCC3)cc1)C(=O)O
chemicalCompound:molecularF...	C29H46N2O3S
chemicalCompound:moleculeId	25497
chemicalCompound:mwFreebase	502.752
chemicalCompound:alogp	7.647
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	94.94
chemicalCompound:rtb	12
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	2
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.786
chemicalCompound:acdLogP	7.908
chemicalCompound:acdLogD	4.521
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	502.752
chemicalCompound:chemblId	CHEMBL21241
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:125497
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	GW-7647
chemicalCompound:activity	activity:645182, activity:645183, activity:645184, activity:645185, activity:645186, activity:645187, activity:645188, activity:645189, activity:645190, activity:645191, activity:2098166, activity:2098192, activity:2098193, activity:2244423, activity:2244424, activity:2477311, activity:2926655, activity:2926673, activity:2926709, activity:3246519, activity:3246520, activity:3481258, activity:3489257, activity:3492380, activity:3639457, activity:3659449, activity:3671974, activity:3690354, activity:3693096, activity:3802546, activity:3807823, activity:3897248, activity:3928209, activity:3980469, activity:3989048, activity:4002701, activity:4017405, activity:4047567, activity:4050737, activity:4064054, activity:4069512, activity:4126880, activity:4150108, activity:4152524, activity:4278726, activity:4358807, activity:4403320, activity:4468675, activity:4520291, activity:4534534, activity:4536026, activity:4585256, activity:4663295, activity:4723601, activity:4749807, activity:4749878, activity:4834721, activity:4874139, activity:4908963, activity:4929862, activity:4933743, activity:4961367, activity:4986046, activity:5025299, activity:5026856