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218814
Source:
http://linkedlifedata.com/resource/chembl/compound/218814
Search
Subject
Predicate
Object
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(
45
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:218814
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:218814
chemicalCompound:standardIn...
InChI=1S/C21H20FN5O4/c1-13(28)24-10-16-11-27(21(29)31-16)15-2-3-20(18(22)8-15)26-6-4-14(5-7-26)17-12-30-25-19(17)9-23/h2-4,8,12,16H,5-7,10-11H2,1H3,(H,24,28)/t16-/m0/s1
lld:chembl
chemicalCompound:218814
chemicalCompound:standardIn...
DZECIFKNFWRGNB-INIZCTEOSA-N
lld:chembl
chemicalCompound:218814
chemicalCompound:canonicalS...
CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(N3CCC(=CC3)c4conc4C#N)c(F)c2
lld:chembl
chemicalCompound:218814
chemicalCompound:molecularF...
C21 H20 F N5 O4
lld:chembl
chemicalCompound:218814
chemicalCompound:moleculeId
218814
lld:chembl
chemicalCompound:218814
chemicalCompound:mwFreebase
425.413
lld:chembl
chemicalCompound:218814
chemicalCompound:alogp
2.054
lld:chembl
chemicalCompound:218814
chemicalCompound:hba
6
lld:chembl
chemicalCompound:218814
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:218814
chemicalCompound:psa
111.69
lld:chembl
chemicalCompound:218814
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:218814
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:218814
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:218814
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:218814
chemicalCompound:acdLogP
-0.575
lld:chembl
chemicalCompound:218814
chemicalCompound:acdLogD
-0.577
lld:chembl
chemicalCompound:218814
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:218814
chemicalCompound:fullMwt
425.413
lld:chembl
chemicalCompound:218814
chemicalCompound:acdMostBpk...
4.824
lld:chembl
chemicalCompound:218814
chemicalCompound:chemblId
CHEMBL133840
lld:chembl
chemicalCompound:218814
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:218814
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:218814
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:218814
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:218814
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:218814
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:218814
chemicalCompound:oral
No
lld:chembl
chemicalCompound:218814
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:218814
chemicalCompound:topical
No
lld:chembl
chemicalCompound:218814
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:218814
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:218814
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381185
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381186
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381187
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381188
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381189
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381190
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381191
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381192
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381193
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381194
lld:chembl
chemicalCompound:218814
chemicalCompound:activity
activity:381195
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:218814
lld:chembl