403132

Source:http://linkedlifedata.com/resource/chembl/compound/403132

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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/C30H41N7O6/c1-32-23(15-21-11-7-5-8-12-21)30(43)36(3)20-28(41)35(2)19-26(39)33-17-25(38)34-18-27(40)37(4)24(29(31)42)16-22-13-9-6-10-14-22/h5-14,23-24,32H,15-20H2,1-4H3,(H2,31,42)(H,33,39)(H,34,38)/t23-,24-/m0/s1
chemicalCompound:standardIn...	DMVGHORYUZJPPS-ZEQRLZLVSA-N
chemicalCompound:canonicalS...	CN[C@@H](Cc1ccccc1)C(=O)N(C)CC(=O)N(C)CC(=O)NCC(=O)NCC(=O)N(C)[C@@H](Cc2ccccc2)C(=O)N
chemicalCompound:molecularF...	C30 H41 N7 O6
chemicalCompound:moleculeId	403132
chemicalCompound:mwFreebase	595.69
chemicalCompound:alogp	-1.366
chemicalCompound:hba	7
chemicalCompound:hbd	4
chemicalCompound:psa	174.25
chemicalCompound:rtb	16
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.304
chemicalCompound:acdLogP	0
chemicalCompound:acdLogD	-0.659
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	595.69
chemicalCompound:acdMostBpk...	7.953
chemicalCompound:chemblId	CHEMBL237414
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:503132
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:2005652, activity:2005671