99755

Source:http://linkedlifedata.com/resource/chembl/compound/99755

Download in:

Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:99755_MG-132_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C26H41N3O5/c1-17(2)12-21(15-30)27-24(31)22(13-18(3)4)28-25(32)23(14-19(5)6)29-26(33)34-16-20-10-8-7-9-11-20/h7-11,15,17-19,21-23H,12-14,16H2,1-6H3,(H,27,31)(H,28,32)(H,29,33)/t21-,22-,23-/m0/s1
chemicalCompound:standardIn...	TZYWCYJVHRLUCT-VABKMULXSA-N
chemicalCompound:canonicalS...	CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1)C=O
chemicalCompound:molecularF...	C26H41N3O5
chemicalCompound:moleculeId	99755
chemicalCompound:mwFreebase	475.621
chemicalCompound:alogp	4.371
chemicalCompound:hba	5
chemicalCompound:hbd	3
chemicalCompound:psa	113.6
chemicalCompound:rtb	15
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.137
chemicalCompound:acdLogP	5.8
chemicalCompound:acdLogD	5.799
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	475.621
chemicalCompound:chemblId	CHEMBL64925
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:199755
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	MG-132
chemicalCompound:activity	activity:102254, activity:505283, activity:668699, activity:1280975, activity:1603175, activity:1714440, activity:1714456, activity:1714458, activity:1714461, activity:1714464, activity:1714496, activity:1714504, activity:1714542, activity:1714612, activity:1875374, activity:1885128, activity:1885134, activity:1885266, activity:2088811, activity:2088812, activity:2088813, activity:2088814, activity:2088815, activity:2088816, activity:2088817, activity:2115534, activity:2115544, activity:2115554, activity:2151263, activity:2151272, activity:2185287, activity:2197884, activity:2233112, activity:2233126, activity:2233140, activity:2255858, activity:2255863, activity:2255868, activity:2255873, activity:2255880, activity:2255882, activity:2276952, activity:2276962, activity:2277665, activity:2557452, activity:2557453, activity:2557801, activity:2557802, activity:2557803, activity:2557804, activity:2697978, activity:2697979, activity:2697980, activity:2697981, activity:2697982, activity:2697983, activity:3007882, activity:3244144, activity:3244145, activity:3244147, activity:3244148, activity:3244150, activity:3244161, activity:3244163, activity:3244167