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431802
Source:
http://linkedlifedata.com/resource/chembl/compound/431802
Search
Subject
Predicate
Object
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(
43
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:431802
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:431802
chemicalCompound:standardIn...
InChI=1S/C27H32N2O3/c1-3-18-31-25-12-11-23-21(2)19-26(30)32-27(23)24(25)20-29-16-14-28(15-17-29)13-7-10-22-8-5-4-6-9-22/h4-12,19H,3,13-18,20H2,1-2H3/b10-7+
lld:chembl
chemicalCompound:431802
chemicalCompound:standardIn...
DSLKASRUFQOCAM-JXMROGBWSA-N
lld:chembl
chemicalCompound:431802
chemicalCompound:canonicalS...
CCCOc1ccc2C(=CC(=O)Oc2c1CN3CCN(C\C=C\c4ccccc4)CC3)C
lld:chembl
chemicalCompound:431802
chemicalCompound:molecularF...
C27 H32 N2 O3
lld:chembl
chemicalCompound:431802
chemicalCompound:moleculeId
431802
lld:chembl
chemicalCompound:431802
chemicalCompound:mwFreebase
432.555
lld:chembl
chemicalCompound:431802
chemicalCompound:alogp
5.284
lld:chembl
chemicalCompound:431802
chemicalCompound:hba
5
lld:chembl
chemicalCompound:431802
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:431802
chemicalCompound:psa
42.01
lld:chembl
chemicalCompound:431802
chemicalCompound:rtb
8
lld:chembl
chemicalCompound:431802
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:431802
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:431802
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:431802
chemicalCompound:acdLogP
5.337
lld:chembl
chemicalCompound:431802
chemicalCompound:acdLogD
5.165
lld:chembl
chemicalCompound:431802
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:431802
chemicalCompound:fullMwt
432.555
lld:chembl
chemicalCompound:431802
chemicalCompound:acdMostBpk...
7.046
lld:chembl
chemicalCompound:431802
chemicalCompound:chemblId
CHEMBL261412
lld:chembl
chemicalCompound:431802
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:431802
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:431802
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:431802
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:431802
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:431802
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:431802
chemicalCompound:oral
No
lld:chembl
chemicalCompound:431802
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:431802
chemicalCompound:topical
No
lld:chembl
chemicalCompound:431802
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:431802
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:431802
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135168
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135268
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135285
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135383
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135453
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135517
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135581
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135645
lld:chembl
chemicalCompound:431802
chemicalCompound:activity
activity:2135709
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:431802
lld:chembl