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641746
Source:
http://linkedlifedata.com/resource/chembl/compound/641746
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Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:641746
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:641746
chemicalCompound:parent
chemicalCompound:675
lld:chembl
chemicalCompound:641746
chemicalCompound:standardIn...
InChI=1S/C11H13ClN2.C2H2O4/c12-11-4-1-7(6-13-11)9-5-8-2-3-10(9)14-8;3-1(4)2(5)6/h1,4,6,8-10,14H,2-3,5H2;(H,3,4)(H,5,6)
lld:chembl
chemicalCompound:641746
chemicalCompound:standardIn...
CQUYLZUCLDKZFJ-UHFFFAOYSA-N
lld:chembl
chemicalCompound:641746
chemicalCompound:canonicalS...
OC(=O)C(=O)O.Clc1ccc(cn1)C2CC3CCC2N3
lld:chembl
chemicalCompound:641746
chemicalCompound:molecularF...
C13H15ClN2O4
lld:chembl
chemicalCompound:641746
chemicalCompound:moleculeId
641746
lld:chembl
chemicalCompound:641746
chemicalCompound:mwFreebase
208.687
lld:chembl
chemicalCompound:641746
chemicalCompound:alogp
1.838
lld:chembl
chemicalCompound:641746
chemicalCompound:hba
2
lld:chembl
chemicalCompound:641746
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:641746
chemicalCompound:psa
24.92
lld:chembl
chemicalCompound:641746
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:641746
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:641746
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:641746
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:641746
chemicalCompound:acdLogP
1.98
lld:chembl
chemicalCompound:641746
chemicalCompound:acdLogD
-0.503
lld:chembl
chemicalCompound:641746
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:641746
chemicalCompound:fullMwt
298.722
lld:chembl
chemicalCompound:641746
chemicalCompound:acdMostBpk...
10.07
lld:chembl
chemicalCompound:641746
chemicalCompound:chemblId
CHEMBL1160207
lld:chembl
chemicalCompound:641746
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:641746
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:641746
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:641746
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:641746
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:641746
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:641746
chemicalCompound:oral
No
lld:chembl
chemicalCompound:641746
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:641746
chemicalCompound:topical
No
lld:chembl
chemicalCompound:641746
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:641746
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:641746
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:641746
chemicalCompound:activity
activity:313598
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:641746
lld:chembl