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704921
Source:
http://linkedlifedata.com/resource/chembl/compound/704921
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Subject
Predicate
Object
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(
58
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:704921
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:704921
chemicalCompound:parent
chemicalCompound:147
lld:chembl
chemicalCompound:704921
chemicalCompound:standardIn...
InChI=1S/C12H12N2O3.Na/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14;/h4-6H,3H2,1-2H3,(H,16,17);/q;+1/p-1
lld:chembl
chemicalCompound:704921
chemicalCompound:standardIn...
ROKRAUFZFDQWLE-UHFFFAOYSA-M
lld:chembl
chemicalCompound:704921
chemicalCompound:canonicalS...
[Na+].CCN1C=C(C(=O)[O-])C(=O)c2ccc(C)nc12
lld:chembl
chemicalCompound:704921
chemicalCompound:molecularF...
C12H11N2NaO3
lld:chembl
chemicalCompound:704921
chemicalCompound:moleculeId
704921
lld:chembl
chemicalCompound:704921
chemicalCompound:mwFreebase
232.235
lld:chembl
chemicalCompound:704921
chemicalCompound:alogp
1.176
lld:chembl
chemicalCompound:704921
chemicalCompound:hba
5
lld:chembl
chemicalCompound:704921
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:704921
chemicalCompound:psa
70.5
lld:chembl
chemicalCompound:704921
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:704921
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:704921
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:704921
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:704921
chemicalCompound:acdMostApk...
3.454
lld:chembl
chemicalCompound:704921
chemicalCompound:acdLogP
0.025
lld:chembl
chemicalCompound:704921
chemicalCompound:acdLogD
-1.536
lld:chembl
chemicalCompound:704921
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:704921
chemicalCompound:fullMwt
254.217
lld:chembl
chemicalCompound:704921
chemicalCompound:acdMostBpk...
6.117
lld:chembl
chemicalCompound:704921
chemicalCompound:chemblId
CHEMBL1255939
lld:chembl
chemicalCompound:704921
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:704921
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:704921
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:704921
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:704921
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:704921
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:704921
chemicalCompound:oral
No
lld:chembl
chemicalCompound:704921
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:704921
chemicalCompound:topical
No
lld:chembl
chemicalCompound:704921
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:704921
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:704921
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:3473147
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:3637237
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:3672732
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:3722183
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4128549
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4303696
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4424454
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4446840
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4586013
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4682570
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4745976
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4881508
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:4925841
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:5825701
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:5996056
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:6007886
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:6033393
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:6049788
lld:chembl
chemicalCompound:704921
chemicalCompound:activity
activity:6052921
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:704921
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:704921
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:704921
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:704921
lld:chembl