924329

Source:http://linkedlifedata.com/resource/chembl/compound/924329

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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/C26H45NO4/c1-2-3-6-12-23(29)17-15-21-16-18-25(30)24(21)13-7-4-5-8-14-26(31)27-19-10-9-11-22(27)20-28/h15,17,21-24,28-29H,2-14,16,18-20H2,1H3/b17-15+/t21-,22?,23-,24+/m0/s1
chemicalCompound:standardIn...	PUWRAXNZOZMMTO-UKLGAOHVSA-N
chemicalCompound:canonicalS...	CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N2CCCCC2CO
chemicalCompound:molecularF...	C26H45NO4
chemicalCompound:moleculeId	924329
chemicalCompound:mwFreebase	435.64
chemicalCompound:alogp	4.869
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	77.84
chemicalCompound:rtb	14
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	5.069
chemicalCompound:acdLogD	5.069
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	435.64
chemicalCompound:chemblId	CHEMBL1500445
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1024329
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:3615742, activity:4562363, activity:5411216, activity:5500137, activity:5561281, activity:5875083, activity:6460883, activity:6520005, activity:6777809, activity:6946527, activity:7091929, activity:7350344, activity:7536178, activity:9967589