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799217
Source:
http://linkedlifedata.com/resource/chembl/compound/799217
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Subject
Predicate
Object
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(
41
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:799217
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:799217
chemicalCompound:standardIn...
InChI=1S/C20H17N7O2S/c1-13(28)22-15-4-6-16(7-5-15)23-18(29)12-30-19-9-8-17-24-25-20(27(17)26-19)14-3-2-10-21-11-14/h2-11H,12H2,1H3,(H,22,28)(H,23,29)
lld:chembl
chemicalCompound:799217
chemicalCompound:standardIn...
WFAWVCVJPPDKNR-UHFFFAOYSA-N
lld:chembl
chemicalCompound:799217
chemicalCompound:canonicalS...
CC(=O)Nc1ccc(NC(=O)CSc2ccc3nnc(c4cccnc4)n3n2)cc1
lld:chembl
chemicalCompound:799217
chemicalCompound:molecularF...
C20H17N7O2S
lld:chembl
chemicalCompound:799217
chemicalCompound:moleculeId
799217
lld:chembl
chemicalCompound:799217
chemicalCompound:mwFreebase
419.46
lld:chembl
chemicalCompound:799217
chemicalCompound:alogp
1.465
lld:chembl
chemicalCompound:799217
chemicalCompound:hba
7
lld:chembl
chemicalCompound:799217
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:799217
chemicalCompound:psa
139.47
lld:chembl
chemicalCompound:799217
chemicalCompound:rtb
6
lld:chembl
chemicalCompound:799217
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:799217
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:799217
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:799217
chemicalCompound:acdMostApk...
12.214
lld:chembl
chemicalCompound:799217
chemicalCompound:acdLogP
1.925
lld:chembl
chemicalCompound:799217
chemicalCompound:acdLogD
1.925
lld:chembl
chemicalCompound:799217
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:799217
chemicalCompound:fullMwt
419.46
lld:chembl
chemicalCompound:799217
chemicalCompound:acdMostBpk...
2.256
lld:chembl
chemicalCompound:799217
chemicalCompound:chemblId
CHEMBL1375333
lld:chembl
chemicalCompound:799217
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:799217
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:799217
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:799217
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:799217
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:799217
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:799217
chemicalCompound:oral
No
lld:chembl
chemicalCompound:799217
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:799217
chemicalCompound:topical
No
lld:chembl
chemicalCompound:799217
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:799217
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:799217
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:799217
chemicalCompound:activity
activity:5036318
lld:chembl
chemicalCompound:799217
chemicalCompound:activity
activity:5413965
lld:chembl
chemicalCompound:799217
chemicalCompound:activity
activity:5570652
lld:chembl
chemicalCompound:799217
chemicalCompound:activity
activity:5754837
lld:chembl
chemicalCompound:799217
chemicalCompound:activity
activity:5857370
lld:chembl
chemicalCompound:799217
chemicalCompound:activity
activity:8314028
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:799217
lld:chembl