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188825
Source:
http://linkedlifedata.com/resource/chembl/compound/188825
Search
Subject
Predicate
Object
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(
44
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:188825
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:188825
chemicalCompound:standardIn...
InChI=1S/C24H23ClFN5O2/c1-14(31(2)3)5-8-23(32)30-21-10-17-20(11-22(21)33-4)28-13-15(12-27)24(17)29-16-6-7-19(26)18(25)9-16/h5-11,13-14H,1-4H3,(H,28,29)(H,30,32)/b8-5+
lld:chembl
chemicalCompound:188825
chemicalCompound:standardIn...
LQJFAOUCESCUCC-VMPITWQZSA-N
lld:chembl
chemicalCompound:188825
chemicalCompound:canonicalS...
COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N(C)C
lld:chembl
chemicalCompound:188825
chemicalCompound:molecularF...
C24 H23 Cl F N5 O2
lld:chembl
chemicalCompound:188825
chemicalCompound:moleculeId
188825
lld:chembl
chemicalCompound:188825
chemicalCompound:mwFreebase
467.923
lld:chembl
chemicalCompound:188825
chemicalCompound:alogp
4.484
lld:chembl
chemicalCompound:188825
chemicalCompound:hba
6
lld:chembl
chemicalCompound:188825
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:188825
chemicalCompound:psa
90.28
lld:chembl
chemicalCompound:188825
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:188825
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:188825
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:188825
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:188825
chemicalCompound:acdMostApk...
12.066
lld:chembl
chemicalCompound:188825
chemicalCompound:acdLogP
1.955
lld:chembl
chemicalCompound:188825
chemicalCompound:acdLogD
1.241
lld:chembl
chemicalCompound:188825
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:188825
chemicalCompound:fullMwt
467.923
lld:chembl
chemicalCompound:188825
chemicalCompound:acdMostBpk...
8.09
lld:chembl
chemicalCompound:188825
chemicalCompound:chemblId
CHEMBL113901
lld:chembl
chemicalCompound:188825
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:188825
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:188825
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:188825
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:188825
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:188825
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:188825
chemicalCompound:oral
No
lld:chembl
chemicalCompound:188825
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:188825
chemicalCompound:topical
No
lld:chembl
chemicalCompound:188825
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:188825
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:188825
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:368906
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:368907
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:368908
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:368909
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:368910
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:1052748
lld:chembl
chemicalCompound:188825
chemicalCompound:activity
activity:6261380
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:188825
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:188825
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:188825
lld:chembl