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1273358
Source:
http://linkedlifedata.com/resource/chembl/compound/1273358
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Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:1273358
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1273358
chemicalCompound:standardIn...
InChI=1S/C27H30ClN3O/c1-27(24-11-16-29-17-12-24,23-7-9-25(28)10-8-23)30-26(32)15-20-31-18-13-22(14-19-31)21-5-3-2-4-6-21/h2-12,16-17,22H,13-15,18-20H2,1H3,(H,30,32)
lld:chembl
chemicalCompound:1273358
chemicalCompound:standardIn...
ZYPYRTNKOSHLCU-UHFFFAOYSA-N
lld:chembl
chemicalCompound:1273358
chemicalCompound:canonicalS...
CC(NC(=O)CCN1CCC(CC1)c2ccccc2)(c3ccncc3)c4ccc(Cl)cc4
lld:chembl
chemicalCompound:1273358
chemicalCompound:molecularF...
C27H30ClN3O
lld:chembl
chemicalCompound:1273358
chemicalCompound:moleculeId
1273358
lld:chembl
chemicalCompound:1273358
chemicalCompound:mwFreebase
448
lld:chembl
chemicalCompound:1273358
chemicalCompound:alogp
4.743
lld:chembl
chemicalCompound:1273358
chemicalCompound:hba
3
lld:chembl
chemicalCompound:1273358
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:1273358
chemicalCompound:psa
45.23
lld:chembl
chemicalCompound:1273358
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:1273358
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:1273358
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:1273358
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:1273358
chemicalCompound:acdMostApk...
13.133
lld:chembl
chemicalCompound:1273358
chemicalCompound:acdLogP
4.957
lld:chembl
chemicalCompound:1273358
chemicalCompound:acdLogD
4.197
lld:chembl
chemicalCompound:1273358
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:1273358
chemicalCompound:fullMwt
448
lld:chembl
chemicalCompound:1273358
chemicalCompound:acdMostBpk...
8.313
lld:chembl
chemicalCompound:1273358
chemicalCompound:chemblId
CHEMBL1938523
lld:chembl
chemicalCompound:1273358
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1273358
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1273358
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1273358
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1273358
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1273358
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1273358
chemicalCompound:activity
activity:8008596
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1273358
lld:chembl