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83733
Source:
http://linkedlifedata.com/resource/chembl/compound/83733
Search
Subject
Predicate
Object
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(
40
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:83733
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:83733
chemicalCompound:standardIn...
InChI=1S/C12H20N5O4P/c1-3-20-22(18,21-4-2)9-19-6-5-17-8-16-10-11(13)14-7-15-12(10)17/h7-8H,3-6,9H2,1-2H3,(H2,13,14,15)
lld:chembl
chemicalCompound:83733
chemicalCompound:standardIn...
SACBMARVYGBCAK-UHFFFAOYSA-N
lld:chembl
chemicalCompound:83733
chemicalCompound:canonicalS...
CCOP(=O)(COCCn1cnc2c(N)ncnc12)OCC
lld:chembl
chemicalCompound:83733
chemicalCompound:molecularF...
C12 H20 N5 O4 P
lld:chembl
chemicalCompound:83733
chemicalCompound:moleculeId
83733
lld:chembl
chemicalCompound:83733
chemicalCompound:mwFreebase
329.292
lld:chembl
chemicalCompound:83733
chemicalCompound:alogp
-0.373
lld:chembl
chemicalCompound:83733
chemicalCompound:hba
8
lld:chembl
chemicalCompound:83733
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:83733
chemicalCompound:psa
124.19
lld:chembl
chemicalCompound:83733
chemicalCompound:rtb
9
lld:chembl
chemicalCompound:83733
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:83733
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:83733
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:83733
chemicalCompound:acdLogP
0.725
lld:chembl
chemicalCompound:83733
chemicalCompound:acdLogD
0.724
lld:chembl
chemicalCompound:83733
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:83733
chemicalCompound:fullMwt
329.292
lld:chembl
chemicalCompound:83733
chemicalCompound:acdMostBpk...
4.184
lld:chembl
chemicalCompound:83733
chemicalCompound:chemblId
CHEMBL55800
lld:chembl
chemicalCompound:83733
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:83733
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:83733
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:83733
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:83733
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:83733
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:83733
chemicalCompound:oral
No
lld:chembl
chemicalCompound:83733
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:83733
chemicalCompound:topical
No
lld:chembl
chemicalCompound:83733
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:83733
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:83733
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:83733
chemicalCompound:activity
activity:525594
lld:chembl
chemicalCompound:83733
chemicalCompound:activity
activity:525595
lld:chembl
chemicalCompound:83733
chemicalCompound:activity
activity:525596
lld:chembl
chemicalCompound:83733
chemicalCompound:activity
activity:888064
lld:chembl
chemicalCompound:83733
chemicalCompound:activity
activity:888065
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:83733
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:83733
lld:chembl