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257102
Source:
http://linkedlifedata.com/resource/chembl/compound/257102
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Subject
(
35
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C15H26N2O5/c1-2-11(17-14(20)12(16)8-13(18)19)9-22-15(21)10-6-4-3-5-7-10/h10-12H,2-9,16H2,1H3,(H,17,20)(H,18,19)/t11-,12+/m0/s1
chemicalCompound:standardIn...
GAEFWMZOHRFHFI-NWDGAFQWSA-N
chemicalCompound:canonicalS...
CC[C@@H](COC(=O)C1CCCCC1)NC(=O)[C@H](N)CC(=O)O
chemicalCompound:molecularF...
C15 H26 N2 O5
chemicalCompound:moleculeId
257102
chemicalCompound:mwFreebase
314.377
chemicalCompound:alogp
-1.335
chemicalCompound:hba
6
chemicalCompound:hbd
3
chemicalCompound:psa
118.72
chemicalCompound:rtb
9
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
3.728
chemicalCompound:acdLogP
1.87
chemicalCompound:acdLogD
-0.805
chemicalCompound:molecularS...
molecularSpecies:ACID
chemicalCompound:fullMwt
314.377
chemicalCompound:acdMostBpk...
7.848
chemicalCompound:chemblId
CHEMBL151681
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:357102
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity
activity:31942