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691130
Source:
http://linkedlifedata.com/resource/chembl/compound/691130
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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:691130
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:691130
chemicalCompound:standardIn...
InChI=1S/C23H21FN4O3/c1-14-12-27(13-25-14)20-9-4-16(11-21(20)31-3)10-19-22(29)28(23(30)26-19)15(2)17-5-7-18(24)8-6-17/h4-13,15H,1-3H3,(H,26,30)/b19-10-/t15-/m0/s1
lld:chembl
chemicalCompound:691130
chemicalCompound:standardIn...
DQPRQEYWAYIBFI-HNIBHBHRSA-N
lld:chembl
chemicalCompound:691130
chemicalCompound:canonicalS...
COc1cc(\C=C\2/N=C(O)N([C@@H](C)c3ccc(F)cc3)C2=O)ccc1n4cnc(C)c4
lld:chembl
chemicalCompound:691130
chemicalCompound:molecularF...
C23H21FN4O3
lld:chembl
chemicalCompound:691130
chemicalCompound:moleculeId
691130
lld:chembl
chemicalCompound:691130
chemicalCompound:mwFreebase
420.436
lld:chembl
chemicalCompound:691130
chemicalCompound:alogp
3.727
lld:chembl
chemicalCompound:691130
chemicalCompound:hba
5
lld:chembl
chemicalCompound:691130
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:691130
chemicalCompound:psa
79.95
lld:chembl
chemicalCompound:691130
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:691130
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:691130
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:691130
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:691130
chemicalCompound:acdMostApk...
8.045
lld:chembl
chemicalCompound:691130
chemicalCompound:acdLogP
3.088
lld:chembl
chemicalCompound:691130
chemicalCompound:acdLogD
1.857
lld:chembl
chemicalCompound:691130
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:691130
chemicalCompound:fullMwt
420.436
lld:chembl
chemicalCompound:691130
chemicalCompound:acdMostBpk...
5.538
lld:chembl
chemicalCompound:691130
chemicalCompound:chemblId
CHEMBL1224671
lld:chembl
chemicalCompound:691130
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:691130
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:691130
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:691130
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:691130
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:691130
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:691130
chemicalCompound:oral
No
lld:chembl
chemicalCompound:691130
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:691130
chemicalCompound:topical
No
lld:chembl
chemicalCompound:691130
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:691130
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:691130
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:691130
chemicalCompound:activity
activity:3413559
lld:chembl
chemicalCompound:691130
chemicalCompound:activity
activity:3413560
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:691130
lld:chembl