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306308
Source:
http://linkedlifedata.com/resource/chembl/compound/306308
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Subject
(
34
)
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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/C16H10O6/c17-9-4-10(18)16-11(19)6-13(22-15(16)5-9)8-1-2-12-14(3-8)21-7-20-12/h1-6,17-18H,7H2
chemicalCompound:standardIn...
LHUUGUDSYBWEPF-UHFFFAOYSA-N
chemicalCompound:canonicalS...
Oc1cc(O)c2C(=O)C=C(Oc2c1)c3ccc4OCOc4c3
chemicalCompound:molecularF...
C16 H10 O6
chemicalCompound:moleculeId
306308
chemicalCompound:mwFreebase
298.247
chemicalCompound:alogp
2.42
chemicalCompound:hba
6
chemicalCompound:hbd
2
chemicalCompound:psa
85.22
chemicalCompound:rtb
1
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
6.503
chemicalCompound:acdLogP
2.384
chemicalCompound:acdLogD
1.173
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
298.247
chemicalCompound:chemblId
CHEMBL181600
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:406308
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:1441549