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419994
Source:
http://linkedlifedata.com/resource/chembl/compound/419994
Search
Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:419994
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:419994
chemicalCompound:standardIn...
InChI=1S/C17H17N3O5/c18-16(24)13-11(7-6-10-4-2-1-3-5-10)8-20(19-13)17-15(23)14(22)12(9-21)25-17/h1-5,8,12,14-15,17,21-23H,9H2,(H2,18,24)/t12-,14-,15-,17-/m1/s1
lld:chembl
chemicalCompound:419994
chemicalCompound:standardIn...
IXSVQAIOCGFUJM-DNNBLBMLSA-N
lld:chembl
chemicalCompound:419994
chemicalCompound:canonicalS...
NC(=O)c1nn(cc1C#Cc2ccccc2)[C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O
lld:chembl
chemicalCompound:419994
chemicalCompound:molecularF...
C17 H17 N3 O5
lld:chembl
chemicalCompound:419994
chemicalCompound:moleculeId
419994
lld:chembl
chemicalCompound:419994
chemicalCompound:mwFreebase
343.334
lld:chembl
chemicalCompound:419994
chemicalCompound:alogp
0.374
lld:chembl
chemicalCompound:419994
chemicalCompound:hba
6
lld:chembl
chemicalCompound:419994
chemicalCompound:hbd
4
lld:chembl
chemicalCompound:419994
chemicalCompound:psa
130.83
lld:chembl
chemicalCompound:419994
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:419994
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:419994
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:419994
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:419994
chemicalCompound:acdMostApk...
13.092
lld:chembl
chemicalCompound:419994
chemicalCompound:acdLogP
0.5
lld:chembl
chemicalCompound:419994
chemicalCompound:acdLogD
0.5
lld:chembl
chemicalCompound:419994
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:419994
chemicalCompound:fullMwt
343.334
lld:chembl
chemicalCompound:419994
chemicalCompound:chemblId
CHEMBL428058
lld:chembl
chemicalCompound:419994
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:419994
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:419994
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:419994
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:419994
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:419994
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:419994
chemicalCompound:oral
No
lld:chembl
chemicalCompound:419994
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:419994
chemicalCompound:topical
No
lld:chembl
chemicalCompound:419994
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:419994
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:419994
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:419994
chemicalCompound:activity
activity:2063881
lld:chembl
chemicalCompound:419994
chemicalCompound:activity
activity:2063884
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:419994
lld:chembl