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972951
Source:
http://linkedlifedata.com/resource/chembl/compound/972951
Search
Subject
Predicate
Object
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(
47
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:972951
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:972951
chemicalCompound:parent
chemicalCompound:1047385
lld:chembl
chemicalCompound:972951
chemicalCompound:standardIn...
InChI=1S/C25H26N4O3.ClH/c1-27-11-13-28(14-12-27)24(30)10-8-20-18-29(21-5-3-2-4-6-21)26-25(20)19-7-9-22-23(17-19)32-16-15-31-22;/h2-10,17-18H,11-16H2,1H3;1H/b10-8+;
lld:chembl
chemicalCompound:972951
chemicalCompound:standardIn...
QWBWDIJYJNDZMC-VRTOBVRTSA-N
lld:chembl
chemicalCompound:972951
chemicalCompound:canonicalS...
Cl.CN1CCN(CC1)C(=O)\C=C\c2cn(nc2c3ccc4OCCOc4c3)c5ccccc5
lld:chembl
chemicalCompound:972951
chemicalCompound:molecularF...
C25H27ClN4O3
lld:chembl
chemicalCompound:972951
chemicalCompound:moleculeId
972951
lld:chembl
chemicalCompound:972951
chemicalCompound:mwFreebase
430.499
lld:chembl
chemicalCompound:972951
chemicalCompound:alogp
3.628
lld:chembl
chemicalCompound:972951
chemicalCompound:hba
5
lld:chembl
chemicalCompound:972951
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:972951
chemicalCompound:psa
59.83
lld:chembl
chemicalCompound:972951
chemicalCompound:rtb
4
lld:chembl
chemicalCompound:972951
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:972951
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:972951
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:972951
chemicalCompound:acdLogP
1.68
lld:chembl
chemicalCompound:972951
chemicalCompound:acdLogD
1.601
lld:chembl
chemicalCompound:972951
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:972951
chemicalCompound:fullMwt
466.96
lld:chembl
chemicalCompound:972951
chemicalCompound:acdMostBpk...
6.746
lld:chembl
chemicalCompound:972951
chemicalCompound:chemblId
CHEMBL1549067
lld:chembl
chemicalCompound:972951
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:972951
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:972951
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:972951
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:972951
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:972951
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:972951
chemicalCompound:oral
No
lld:chembl
chemicalCompound:972951
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:972951
chemicalCompound:topical
No
lld:chembl
chemicalCompound:972951
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:972951
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:972951
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:3733218
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:4290116
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:4586494
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:5747285
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:5822555
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:5935558
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:6680416
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:7124095
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:7358755
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:7445180
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:8995633
lld:chembl
chemicalCompound:972951
chemicalCompound:activity
activity:9693753
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:972951
lld:chembl