251940

Source:http://linkedlifedata.com/resource/chembl/compound/251940

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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/C32H44N2O10/c1-19(2)23(31(39)41-5)33-29(37)27(43-17-21-13-9-7-10-14-21)25(35)26(36)28(44-18-22-15-11-8-12-16-22)30(38)34-24(20(3)4)32(40)42-6/h7-16,19-20,23-28,35-36H,17-18H2,1-6H3,(H,33,37)(H,34,38)/t23?,24?,25-,26-,27-,28-/m1/s1
chemicalCompound:standardIn...	WAVMWAUXGCZCQW-JKXUJLOOSA-N
chemicalCompound:canonicalS...	COC(=O)C(NC(=O)[C@H](OCc1ccccc1)[C@H](O)[C@@H](O)[C@@H](OCc2ccccc2)C(=O)NC(C(C)C)C(=O)OC)C(C)C
chemicalCompound:molecularF...	C32 H44 N2 O10
chemicalCompound:moleculeId	251940
chemicalCompound:mwFreebase	616.699
chemicalCompound:alogp	2.524
chemicalCompound:hba	10
chemicalCompound:hbd	4
chemicalCompound:psa	169.71
chemicalCompound:rtb	19
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	12.416
chemicalCompound:acdLogP	6.424
chemicalCompound:acdLogD	6.424
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	616.699
chemicalCompound:chemblId	CHEMBL358219
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:351940
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:150264, activity:150265, activity:150266, activity:150267