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201789
Source:
http://linkedlifedata.com/resource/chembl/compound/201789
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Subject
(
34
)
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Inference
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Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C24H24N2O4/c1-3-30-20-15-14-19(16-21(20)29-2)22(25-23(27)17-10-6-4-7-11-17)26-24(28)18-12-8-5-9-13-18/h4-16,22H,3H2,1-2H3,(H,25,27)(H,26,28)
chemicalCompound:standardIn...
MPESWPYJWFPIIC-UHFFFAOYSA-N
chemicalCompound:canonicalS...
CCOc1ccc(cc1OC)C(NC(=O)c2ccccc2)NC(=O)c3ccccc3
chemicalCompound:molecularF...
C24 H24 N2 O4
chemicalCompound:moleculeId
201789
chemicalCompound:mwFreebase
404.458
chemicalCompound:alogp
3.994
chemicalCompound:hba
4
chemicalCompound:hbd
2
chemicalCompound:psa
76.66
chemicalCompound:rtb
8
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
12.385
chemicalCompound:acdLogP
2.798
chemicalCompound:acdLogD
2.798
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
404.458
chemicalCompound:chemblId
CHEMBL122866
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:301789
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:424147