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158280
Source:
http://linkedlifedata.com/resource/chembl/compound/158280
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Subject
Predicate
Object
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(
33
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:158280
chemicalCompound:standardIn...
InChI=1S/C14H18BrN/c15-13-7-2-1-6-12(13)14-9-8-11-5-3-4-10-16(11)14/h1-2,6-7,11,14H,3-5,8-10H2/t11-,14-/m1/s1
lld:chembl
chemicalCompound:158280
chemicalCompound:standardIn...
NYBDMYWOGLTJBP-BXUZGUMPSA-N
lld:chembl
chemicalCompound:158280
chemicalCompound:canonicalS...
Brc1ccccc1[C@H]2CC[C@H]3CCCCN23
lld:chembl
chemicalCompound:158280
chemicalCompound:molecularF...
C14 H18 Br N
lld:chembl
chemicalCompound:158280
chemicalCompound:moleculeId
158280
lld:chembl
chemicalCompound:158280
chemicalCompound:mwFreebase
280.203
lld:chembl
chemicalCompound:158280
chemicalCompound:alogp
4.087
lld:chembl
chemicalCompound:158280
chemicalCompound:hba
1
lld:chembl
chemicalCompound:158280
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:158280
chemicalCompound:psa
3.24
lld:chembl
chemicalCompound:158280
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:158280
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:158280
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:158280
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:158280
chemicalCompound:acdLogP
3.47
lld:chembl
chemicalCompound:158280
chemicalCompound:acdLogD
1.513
lld:chembl
chemicalCompound:158280
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:158280
chemicalCompound:fullMwt
280.203
lld:chembl
chemicalCompound:158280
chemicalCompound:acdMostBpk...
9.384
lld:chembl
chemicalCompound:158280
chemicalCompound:chemblId
CHEMBL328394
lld:chembl
chemicalCompound:158280
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:158280
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:158280
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:158280
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:158280
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:158280
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:158280
chemicalCompound:oral
No
lld:chembl
chemicalCompound:158280
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:158280
chemicalCompound:topical
No
lld:chembl
chemicalCompound:158280
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:158280
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:158280
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:676861
chemicalCompound:parent
chemicalCompound:158280
lld:chembl