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627972
Source:
http://linkedlifedata.com/resource/chembl/compound/627972
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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:627972
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:627972
chemicalCompound:standardIn...
InChI=1S/C17H18FN3O5/c18-11-8-14(26-12(9-22)15(11)23)21-7-6-13(20-17(21)25)19-16(24)10-4-2-1-3-5-10/h1-7,11-12,14-15,22-23H,8-9H2,(H,19,20,24,25)/t11-,12-,14-,15?/m1/s1
lld:chembl
chemicalCompound:627972
chemicalCompound:standardIn...
JDMVJAAWOFCRPK-TVAMOIRASA-N
lld:chembl
chemicalCompound:627972
chemicalCompound:canonicalS...
OC[C@H]1O[C@H](C[C@@H](F)C1O)N2C=CC(=NC2=O)NC(=O)c3ccccc3
lld:chembl
chemicalCompound:627972
chemicalCompound:molecularF...
C17H18FN3O5
lld:chembl
chemicalCompound:627972
chemicalCompound:moleculeId
627972
lld:chembl
chemicalCompound:627972
chemicalCompound:mwFreebase
363.34
lld:chembl
chemicalCompound:627972
chemicalCompound:alogp
0.454
lld:chembl
chemicalCompound:627972
chemicalCompound:hba
6
lld:chembl
chemicalCompound:627972
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:627972
chemicalCompound:psa
111.46
lld:chembl
chemicalCompound:627972
chemicalCompound:rtb
4
lld:chembl
chemicalCompound:627972
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:627972
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:627972
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:627972
chemicalCompound:acdMostApk...
8.625
lld:chembl
chemicalCompound:627972
chemicalCompound:acdLogP
0.83
lld:chembl
chemicalCompound:627972
chemicalCompound:acdLogD
0.759
lld:chembl
chemicalCompound:627972
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:627972
chemicalCompound:fullMwt
363.34
lld:chembl
chemicalCompound:627972
chemicalCompound:acdMostBpk...
3.563
lld:chembl
chemicalCompound:627972
chemicalCompound:chemblId
CHEMBL1094537
lld:chembl
chemicalCompound:627972
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:627972
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:627972
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:627972
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:627972
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:627972
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:627972
chemicalCompound:oral
No
lld:chembl
chemicalCompound:627972
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:627972
chemicalCompound:topical
No
lld:chembl
chemicalCompound:627972
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:627972
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:627972
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:627972
chemicalCompound:activity
activity:3300099
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:627972
lld:chembl