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875625
Source:
http://linkedlifedata.com/resource/chembl/compound/875625
Search
Subject
(
53
)
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/C14H8Cl2N2O3/c15-7-1-3-9(13(19)20)10(5-7)17-14-18-11-6-8(16)2-4-12(11)21-14/h1-6H,(H,17,18)(H,19,20)
chemicalCompound:standardIn...
QOUHOKVQTSILHJ-UHFFFAOYSA-N
chemicalCompound:canonicalS...
OC(=O)c1ccc(Cl)cc1Nc2oc3ccc(Cl)cc3n2
chemicalCompound:molecularF...
C14H8Cl2N2O3
chemicalCompound:moleculeId
875625
chemicalCompound:mwFreebase
323.131
chemicalCompound:alogp
3.768
chemicalCompound:hba
4
chemicalCompound:hbd
2
chemicalCompound:psa
75.36
chemicalCompound:rtb
3
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
3.336
chemicalCompound:acdLogP
7.513
chemicalCompound:acdLogD
4.41
chemicalCompound:molecularS...
molecularSpecies:ACID
chemicalCompound:fullMwt
323.131
chemicalCompound:chemblId
CHEMBL1451741
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:975625
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity
activity:4107389
,
activity:4108076
,
activity:4540552
,
activity:4906172
,
activity:5432948
,
activity:5501225
,
activity:5565157
,
activity:5584587
,
activity:5874294
,
activity:6440926
,
activity:6551647
,
activity:6724464
,
activity:6763470
,
activity:6988730
,
activity:6999732
,
activity:7243747
,
activity:7261533
,
activity:7429089
,
activity:7526527
,
activity:10788414