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77731
Source:
http://linkedlifedata.com/resource/chembl/compound/77731
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Subject
Predicate
Object
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(
37
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:77731
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:77731
chemicalCompound:standardIn...
InChI=1S/C19H25NO2/c1-3-12-8-15(22)11-19-6-7-20(2)17(18(12)19)9-13-4-5-14(21)10-16(13)19/h4-5,10,12,17-18,21H,3,6-9,11H2,1-2H3/t12-,17?,18-,19?/m1/s1
lld:chembl
chemicalCompound:77731
chemicalCompound:standardIn...
SZIGYSMMOMTFKG-XOZNHLLDSA-N
lld:chembl
chemicalCompound:77731
chemicalCompound:canonicalS...
CC[C@@H]1CC(=O)CC23CCN(C)C(Cc4ccc(O)cc24)[C@@H]13
lld:chembl
chemicalCompound:77731
chemicalCompound:molecularF...
C19 H25 N O2
lld:chembl
chemicalCompound:77731
chemicalCompound:moleculeId
77731
lld:chembl
chemicalCompound:77731
chemicalCompound:mwFreebase
299.407
lld:chembl
chemicalCompound:77731
chemicalCompound:alogp
2.734
lld:chembl
chemicalCompound:77731
chemicalCompound:hba
3
lld:chembl
chemicalCompound:77731
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:77731
chemicalCompound:psa
40.54
lld:chembl
chemicalCompound:77731
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:77731
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:77731
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:77731
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:77731
chemicalCompound:acdMostApk...
10.049
lld:chembl
chemicalCompound:77731
chemicalCompound:acdLogP
3.699
lld:chembl
chemicalCompound:77731
chemicalCompound:acdLogD
2.424
lld:chembl
chemicalCompound:77731
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:77731
chemicalCompound:fullMwt
299.407
lld:chembl
chemicalCompound:77731
chemicalCompound:acdMostBpk...
8.771
lld:chembl
chemicalCompound:77731
chemicalCompound:chemblId
CHEMBL51147
lld:chembl
chemicalCompound:77731
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:77731
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:77731
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:77731
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:77731
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:77731
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:77731
chemicalCompound:oral
No
lld:chembl
chemicalCompound:77731
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:77731
chemicalCompound:topical
No
lld:chembl
chemicalCompound:77731
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:77731
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:77731
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:77731
chemicalCompound:activity
activity:869138
lld:chembl
chemicalCompound:77731
chemicalCompound:activity
activity:869139
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:77731
lld:chembl