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Sources
257281
Source:
http://linkedlifedata.com/resource/chembl/compound/257281
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Subject
(
36
)
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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/C17H31N3/c1(3-5-7-11-17-15-18-16-19-17)2-4-6-8-12-20-13-9-10-14-20/h15-16H,1-14H2,(H,18,19)
chemicalCompound:standardIn...
ZWBZUWWQDRQBAX-UHFFFAOYSA-N
chemicalCompound:canonicalS...
C(CCCCCc1c[nH]cn1)CCCCN2CCCC2
chemicalCompound:molecularF...
C17 H31 N3
chemicalCompound:moleculeId
257281
chemicalCompound:mwFreebase
277.448
chemicalCompound:alogp
4.229
chemicalCompound:hba
2
chemicalCompound:hbd
1
chemicalCompound:psa
31.92
chemicalCompound:rtb
11
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdLogP
4.363
chemicalCompound:acdLogD
1
chemicalCompound:molecularS...
molecularSpecies:BASE
chemicalCompound:fullMwt
277.448
chemicalCompound:acdMostBpk...
10.579
chemicalCompound:chemblId
CHEMBL157217
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:357281
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:153889
,
activity:153890
,
activity:153891