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1218229
Source:
http://linkedlifedata.com/resource/chembl/compound/1218229
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Subject
(
36
)
Predicate
Object
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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/C12H27N/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-12H2,1-3H3
chemicalCompound:standardIn...
IMFACGCPASFAPR-UHFFFAOYSA-N
chemicalCompound:canonicalS...
CCCCN(CCCC)CCCC
chemicalCompound:molecularF...
C12H27N
chemicalCompound:moleculeId
1218229
chemicalCompound:mwFreebase
185.349
chemicalCompound:alogp
4.306
chemicalCompound:hba
1
chemicalCompound:hbd
0
chemicalCompound:psa
3.24
chemicalCompound:rtb
9
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
4.704
chemicalCompound:acdLogD
2.232
chemicalCompound:molecularS...
molecularSpecies:BASE
chemicalCompound:fullMwt
185.349
chemicalCompound:acdMostBpk...
9.988
chemicalCompound:chemblId
CHEMBL1877658
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:1318229
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:7050720
,
activity:7458004
,
activity:7475556