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194948
Source:
http://linkedlifedata.com/resource/chembl/compound/194948
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Subject
Predicate
Object
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(
35
)
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Inference
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Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:194948
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:194948
chemicalCompound:standardIn...
InChI=1S/C17H18N4/c18-16-15(11-20-17(19)21-16)10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15H,10-11H2,(H4,18,19,20,21)
lld:chembl
chemicalCompound:194948
chemicalCompound:standardIn...
UZWIGXZSOSHNKZ-UHFFFAOYSA-N
lld:chembl
chemicalCompound:194948
chemicalCompound:canonicalS...
NC1=NCC(Cc2ccc(cc2)c3ccccc3)C(=N1)N
lld:chembl
chemicalCompound:194948
chemicalCompound:molecularF...
C17 H18 N4
lld:chembl
chemicalCompound:194948
chemicalCompound:moleculeId
194948
lld:chembl
chemicalCompound:194948
chemicalCompound:mwFreebase
278.352
lld:chembl
chemicalCompound:194948
chemicalCompound:alogp
2.666
lld:chembl
chemicalCompound:194948
chemicalCompound:hba
4
lld:chembl
chemicalCompound:194948
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:194948
chemicalCompound:psa
76.75
lld:chembl
chemicalCompound:194948
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:194948
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:194948
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:194948
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:194948
chemicalCompound:acdLogP
2.636
lld:chembl
chemicalCompound:194948
chemicalCompound:acdLogD
0.636
lld:chembl
chemicalCompound:194948
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:194948
chemicalCompound:fullMwt
278.352
lld:chembl
chemicalCompound:194948
chemicalCompound:acdMostBpk...
15.762
lld:chembl
chemicalCompound:194948
chemicalCompound:chemblId
CHEMBL333695
lld:chembl
chemicalCompound:194948
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:194948
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:194948
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:194948
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:194948
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:194948
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:194948
chemicalCompound:oral
No
lld:chembl
chemicalCompound:194948
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:194948
chemicalCompound:topical
No
lld:chembl
chemicalCompound:194948
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:194948
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:194948
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:194948
chemicalCompound:activity
activity:900049
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:194948
lld:chembl