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871728
Source:
http://linkedlifedata.com/resource/chembl/compound/871728
Search
Subject
Predicate
Object
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(
56
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:871728
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:871728
chemicalCompound:standardIn...
InChI=1S/C18H20N2O3/c1-12-5-10-15(11-16(12)20(22)23)19-17(21)13-6-8-14(9-7-13)18(2,3)4/h5-11H,1-4H3,(H,19,21)
lld:chembl
chemicalCompound:871728
chemicalCompound:standardIn...
ZMBYWCPUULJLRQ-UHFFFAOYSA-N
lld:chembl
chemicalCompound:871728
chemicalCompound:canonicalS...
Cc1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)cc1[N+](=O)[O-]
lld:chembl
chemicalCompound:871728
chemicalCompound:molecularF...
C18H20N2O3
lld:chembl
chemicalCompound:871728
chemicalCompound:moleculeId
871728
lld:chembl
chemicalCompound:871728
chemicalCompound:mwFreebase
312.363
lld:chembl
chemicalCompound:871728
chemicalCompound:alogp
4.395
lld:chembl
chemicalCompound:871728
chemicalCompound:hba
3
lld:chembl
chemicalCompound:871728
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:871728
chemicalCompound:psa
74.92
lld:chembl
chemicalCompound:871728
chemicalCompound:rtb
4
lld:chembl
chemicalCompound:871728
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:871728
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:871728
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:871728
chemicalCompound:acdMostApk...
12.88
lld:chembl
chemicalCompound:871728
chemicalCompound:acdLogP
5.984
lld:chembl
chemicalCompound:871728
chemicalCompound:acdLogD
5.984
lld:chembl
chemicalCompound:871728
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:871728
chemicalCompound:fullMwt
312.363
lld:chembl
chemicalCompound:871728
chemicalCompound:chemblId
CHEMBL1447844
lld:chembl
chemicalCompound:871728
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:871728
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:871728
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:871728
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:871728
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:871728
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:871728
chemicalCompound:oral
No
lld:chembl
chemicalCompound:871728
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:871728
chemicalCompound:topical
No
lld:chembl
chemicalCompound:871728
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:871728
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:871728
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:3631316
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:3802955
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:3832971
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:3926537
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:4009261
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:4732051
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:4738157
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:4753528
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:4847325
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:4978442
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5353922
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5410275
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5541428
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5653157
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5683031
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5796511
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:5874090
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:6660449
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:6740896
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:6984967
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:7169251
lld:chembl
chemicalCompound:871728
chemicalCompound:activity
activity:7414413
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:871728
lld:chembl