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272670
Source:
http://linkedlifedata.com/resource/chembl/compound/272670
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Subject
Predicate
Object
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(
37
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:272670
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:272670
chemicalCompound:standardIn...
InChI=1S/C13H18ClNO/c1-13(2,3)10-6-9-8-15-4-5-16-12(9)11(14)7-10/h6-7,15H,4-5,8H2,1-3H3
lld:chembl
chemicalCompound:272670
chemicalCompound:standardIn...
PTJNUJFEBGXXJO-UHFFFAOYSA-N
lld:chembl
chemicalCompound:272670
chemicalCompound:canonicalS...
CC(C)(C)c1cc(Cl)c2OCCNCc2c1
lld:chembl
chemicalCompound:272670
chemicalCompound:molecularF...
C13 H18 Cl N O
lld:chembl
chemicalCompound:272670
chemicalCompound:moleculeId
272670
lld:chembl
chemicalCompound:272670
chemicalCompound:mwFreebase
239.741
lld:chembl
chemicalCompound:272670
chemicalCompound:alogp
3.234
lld:chembl
chemicalCompound:272670
chemicalCompound:hba
2
lld:chembl
chemicalCompound:272670
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:272670
chemicalCompound:psa
21.26
lld:chembl
chemicalCompound:272670
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:272670
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:272670
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:272670
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:272670
chemicalCompound:acdLogP
3.741
lld:chembl
chemicalCompound:272670
chemicalCompound:acdLogD
2.97
lld:chembl
chemicalCompound:272670
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:272670
chemicalCompound:fullMwt
239.741
lld:chembl
chemicalCompound:272670
chemicalCompound:acdMostBpk...
8.092
lld:chembl
chemicalCompound:272670
chemicalCompound:chemblId
CHEMBL350347
lld:chembl
chemicalCompound:272670
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:272670
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:272670
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:272670
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:272670
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:272670
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:272670
chemicalCompound:oral
No
lld:chembl
chemicalCompound:272670
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:272670
chemicalCompound:topical
No
lld:chembl
chemicalCompound:272670
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:272670
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:272670
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:272670
chemicalCompound:activity
activity:35661
lld:chembl
chemicalCompound:272670
chemicalCompound:activity
activity:35662
lld:chembl
chemicalCompound:272670
chemicalCompound:activity
activity:35663
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:272670
lld:chembl