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148101
Source:
http://linkedlifedata.com/resource/chembl/compound/148101
Search
Subject
(
70
)
Predicate
Object
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C7H6O4/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,8-9H,(H,10,11)
chemicalCompound:standardIn...
UIAFKZKHHVMJGS-UHFFFAOYSA-N
chemicalCompound:canonicalS...
OC(=O)c1ccc(O)cc1O
chemicalCompound:molecularF...
C7H6O4
chemicalCompound:moleculeId
148101
chemicalCompound:mwFreebase
154.12
chemicalCompound:alogp
0.975
chemicalCompound:hba
4
chemicalCompound:hbd
3
chemicalCompound:psa
77.76
chemicalCompound:rtb
1
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
3.325
chemicalCompound:acdLogP
1.765
chemicalCompound:acdLogD
-1.39
chemicalCompound:molecularS...
molecularSpecies:ACID
chemicalCompound:fullMwt
154.12
chemicalCompound:chemblId
CHEMBL328910
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:248101
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
2,4-DIHYDROXYBENZOIC ACID
chemicalCompound:activity
activity:99634
,
activity:1014880
,
activity:1941585
,
activity:1941734
,
activity:2175162
,
activity:2175163
,
activity:2175164
,
activity:2175165
,
activity:2175166
,
activity:2175167
,
activity:2214714
,
activity:3902808
,
activity:3912778
,
activity:3915083
,
activity:4174463
,
activity:4202569
,
activity:4370560
,
activity:4699029
,
activity:4726920
,
activity:5193029
,
activity:5193037
,
activity:5193072
,
activity:5193465
,
activity:5193479
,
activity:5193717
,
activity:5194083
,
activity:5194311
,
activity:5194430
,
activity:5938931
,
activity:6536618
,
activity:6609259
,
activity:7011332
,
activity:7047028
,
activity:7062973
,
activity:7555804
,
activity:7558277