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287002
Source:
http://linkedlifedata.com/resource/chembl/compound/287002
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Subject
Predicate
Object
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(
35
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:287002
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:287002
chemicalCompound:standardIn...
InChI=1S/C17H13Cl2N5/c18-11-2-1-9(7-12(11)19)8-24-6-5-10-14(24)4-3-13-15(10)16(20)23-17(21)22-13/h1-7H,8H2,(H4,20,21,22,23)
lld:chembl
chemicalCompound:287002
chemicalCompound:standardIn...
PWASGJZOQDMSDD-UHFFFAOYSA-N
lld:chembl
chemicalCompound:287002
chemicalCompound:canonicalS...
Nc1nc(N)c2c(ccc3c2ccn3Cc4ccc(Cl)c(Cl)c4)n1
lld:chembl
chemicalCompound:287002
chemicalCompound:molecularF...
C17 H13 Cl2 N5
lld:chembl
chemicalCompound:287002
chemicalCompound:moleculeId
287002
lld:chembl
chemicalCompound:287002
chemicalCompound:mwFreebase
358.225
lld:chembl
chemicalCompound:287002
chemicalCompound:alogp
4.366
lld:chembl
chemicalCompound:287002
chemicalCompound:hba
4
lld:chembl
chemicalCompound:287002
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:287002
chemicalCompound:psa
82.75
lld:chembl
chemicalCompound:287002
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:287002
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:287002
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:287002
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:287002
chemicalCompound:acdLogP
4.782
lld:chembl
chemicalCompound:287002
chemicalCompound:acdLogD
3.82
lld:chembl
chemicalCompound:287002
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:287002
chemicalCompound:fullMwt
358.225
lld:chembl
chemicalCompound:287002
chemicalCompound:acdMostBpk...
8.295
lld:chembl
chemicalCompound:287002
chemicalCompound:chemblId
CHEMBL170349
lld:chembl
chemicalCompound:287002
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:287002
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:287002
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:287002
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:287002
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:287002
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:287002
chemicalCompound:oral
No
lld:chembl
chemicalCompound:287002
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:287002
chemicalCompound:topical
No
lld:chembl
chemicalCompound:287002
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:287002
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:287002
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:287002
chemicalCompound:activity
activity:361886
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:287002
lld:chembl