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428706
Source:
http://linkedlifedata.com/resource/chembl/compound/428706
Search
Subject
Predicate
Object
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(
52
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:428706
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:428706
chemicalCompound:standardIn...
InChI=1S/C18H24N6O4/c1-3-5-6-7-8-10-22-15(19)11-16(23-10)24(9-21-11)18-13(26)12(25)14(28-18)17(27)20-4-2/h9,12-14,18,25-26H,3-6H2,1-2H3,(H,20,27)(H2,19,22,23)/t12-,13+,14-,18+/m0/s1
lld:chembl
chemicalCompound:428706
chemicalCompound:standardIn...
FDEACFAXFCKCHZ-MOROJQBDSA-N
lld:chembl
chemicalCompound:428706
chemicalCompound:canonicalS...
CCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@@H]([C@@H](O)[C@H]3O)C(=O)NCC)c2n1
lld:chembl
chemicalCompound:428706
chemicalCompound:molecularF...
C18 H24 N6 O4
lld:chembl
chemicalCompound:428706
chemicalCompound:moleculeId
428706
lld:chembl
chemicalCompound:428706
chemicalCompound:mwFreebase
388.421
lld:chembl
chemicalCompound:428706
chemicalCompound:alogp
0.721
lld:chembl
chemicalCompound:428706
chemicalCompound:hba
8
lld:chembl
chemicalCompound:428706
chemicalCompound:hbd
4
lld:chembl
chemicalCompound:428706
chemicalCompound:psa
148.41
lld:chembl
chemicalCompound:428706
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:428706
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:428706
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:428706
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:428706
chemicalCompound:acdMostApk...
12.89
lld:chembl
chemicalCompound:428706
chemicalCompound:acdLogP
2.81
lld:chembl
chemicalCompound:428706
chemicalCompound:acdLogD
2.81
lld:chembl
chemicalCompound:428706
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:428706
chemicalCompound:fullMwt
388.421
lld:chembl
chemicalCompound:428706
chemicalCompound:acdMostBpk...
2.334
lld:chembl
chemicalCompound:428706
chemicalCompound:chemblId
CHEMBL410873
lld:chembl
chemicalCompound:428706
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:428706
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:428706
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:428706
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:428706
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:428706
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:428706
chemicalCompound:oral
No
lld:chembl
chemicalCompound:428706
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:428706
chemicalCompound:topical
No
lld:chembl
chemicalCompound:428706
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:428706
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:428706
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:3635132
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:3695193
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:3867647
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:3976515
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:3988092
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4084730
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4134978
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4278544
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4358358
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4535852
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4538214
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4828992
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:4966392
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:5570016
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:5696849
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:5855622
lld:chembl
chemicalCompound:428706
chemicalCompound:activity
activity:5875719
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:428706
lld:chembl