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310445
Source:
http://linkedlifedata.com/resource/chembl/compound/310445
Search
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:310445
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:310445
chemicalCompound:standardIn...
InChI=1S/C25H26F3N3O2/c1-33-23-6-3-2-5-22(23)19-9-7-18(8-10-19)17-29-15-4-16-30-24(32)31-21-13-11-20(12-14-21)25(26,27)28/h2-3,5-14,29H,4,15-17H2,1H3,(H2,30,31,32)
lld:chembl
chemicalCompound:310445
chemicalCompound:standardIn...
LXGZVETZCRTLBR-UHFFFAOYSA-N
lld:chembl
chemicalCompound:310445
chemicalCompound:canonicalS...
COc1ccccc1c2ccc(CNCCCNC(=O)Nc3ccc(cc3)C(F)(F)F)cc2
lld:chembl
chemicalCompound:310445
chemicalCompound:molecularF...
C25 H26 F3 N3 O2
lld:chembl
chemicalCompound:310445
chemicalCompound:moleculeId
310445
lld:chembl
chemicalCompound:310445
chemicalCompound:mwFreebase
457.488
lld:chembl
chemicalCompound:310445
chemicalCompound:alogp
4.639
lld:chembl
chemicalCompound:310445
chemicalCompound:hba
3
lld:chembl
chemicalCompound:310445
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:310445
chemicalCompound:psa
62.39
lld:chembl
chemicalCompound:310445
chemicalCompound:rtb
10
lld:chembl
chemicalCompound:310445
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:310445
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:310445
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:310445
chemicalCompound:acdMostApk...
13.603
lld:chembl
chemicalCompound:310445
chemicalCompound:acdLogP
4.813
lld:chembl
chemicalCompound:310445
chemicalCompound:acdLogD
3.123
lld:chembl
chemicalCompound:310445
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:310445
chemicalCompound:fullMwt
457.488
lld:chembl
chemicalCompound:310445
chemicalCompound:acdMostBpk...
9.145
lld:chembl
chemicalCompound:310445
chemicalCompound:chemblId
CHEMBL186388
lld:chembl
chemicalCompound:310445
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:310445
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:310445
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:310445
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:310445
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:310445
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:310445
chemicalCompound:oral
No
lld:chembl
chemicalCompound:310445
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:310445
chemicalCompound:topical
No
lld:chembl
chemicalCompound:310445
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:310445
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:310445
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:310445
chemicalCompound:activity
activity:1456287
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:310445
lld:chembl