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76180
Source:
http://linkedlifedata.com/resource/chembl/compound/76180
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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:76180
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:76180
chemicalCompound:standardIn...
InChI=1S/C16H12FNO4S/c17-12-5-1-11(2-6-12)15-14(9-22-16(15)19)10-3-7-13(8-4-10)23(18,20)21/h1-8H,9H2,(H2,18,20,21)
lld:chembl
chemicalCompound:76180
chemicalCompound:standardIn...
FUUWECMEVRVWJE-UHFFFAOYSA-N
lld:chembl
chemicalCompound:76180
chemicalCompound:canonicalS...
NS(=O)(=O)c1ccc(cc1)C2=C(C(=O)OC2)c3ccc(F)cc3
lld:chembl
chemicalCompound:76180
chemicalCompound:molecularF...
C16 H12 F N O4 S
lld:chembl
chemicalCompound:76180
chemicalCompound:moleculeId
76180
lld:chembl
chemicalCompound:76180
chemicalCompound:mwFreebase
333.334
lld:chembl
chemicalCompound:76180
chemicalCompound:alogp
2.256
lld:chembl
chemicalCompound:76180
chemicalCompound:hba
4
lld:chembl
chemicalCompound:76180
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:76180
chemicalCompound:psa
94.84
lld:chembl
chemicalCompound:76180
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:76180
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:76180
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:76180
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:76180
chemicalCompound:acdMostApk...
10.113
lld:chembl
chemicalCompound:76180
chemicalCompound:acdLogP
-1.065
lld:chembl
chemicalCompound:76180
chemicalCompound:acdLogD
-1.066
lld:chembl
chemicalCompound:76180
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:76180
chemicalCompound:fullMwt
333.334
lld:chembl
chemicalCompound:76180
chemicalCompound:chemblId
CHEMBL431546
lld:chembl
chemicalCompound:76180
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:76180
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:76180
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:76180
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:76180
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:76180
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:76180
chemicalCompound:oral
No
lld:chembl
chemicalCompound:76180
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:76180
chemicalCompound:topical
No
lld:chembl
chemicalCompound:76180
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:76180
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:76180
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:76180
chemicalCompound:activity
activity:1073845
lld:chembl
chemicalCompound:76180
chemicalCompound:activity
activity:1073846
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:76180
lld:chembl