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818540
Source:
http://linkedlifedata.com/resource/chembl/compound/818540
Search
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:818540
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:818540
chemicalCompound:standardIn...
InChI=1S/C21H22ClN3O4S2/c22-15-4-3-5-16(12-15)23-20(26)14-25-18-13-17(31(28,29)24-9-1-2-10-24)6-7-19(18)30-11-8-21(25)27/h3-7,12-13H,1-2,8-11,14H2,(H,23,26)
lld:chembl
chemicalCompound:818540
chemicalCompound:standardIn...
PUOYLJAFTCKDPG-UHFFFAOYSA-N
lld:chembl
chemicalCompound:818540
chemicalCompound:canonicalS...
Clc1cccc(NC(=O)CN2C(=O)CCSc3ccc(cc23)S(=O)(=O)N4CCCC4)c1
lld:chembl
chemicalCompound:818540
chemicalCompound:molecularF...
C21H22ClN3O4S2
lld:chembl
chemicalCompound:818540
chemicalCompound:moleculeId
818540
lld:chembl
chemicalCompound:818540
chemicalCompound:mwFreebase
480
lld:chembl
chemicalCompound:818540
chemicalCompound:alogp
2.511
lld:chembl
chemicalCompound:818540
chemicalCompound:hba
5
lld:chembl
chemicalCompound:818540
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:818540
chemicalCompound:psa
120.46
lld:chembl
chemicalCompound:818540
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:818540
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:818540
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:818540
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:818540
chemicalCompound:acdMostApk...
13.059
lld:chembl
chemicalCompound:818540
chemicalCompound:acdLogP
4.994
lld:chembl
chemicalCompound:818540
chemicalCompound:acdLogD
4.994
lld:chembl
chemicalCompound:818540
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:818540
chemicalCompound:fullMwt
480
lld:chembl
chemicalCompound:818540
chemicalCompound:chemblId
CHEMBL1394656
lld:chembl
chemicalCompound:818540
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:818540
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:818540
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:818540
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:818540
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:818540
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:818540
chemicalCompound:oral
No
lld:chembl
chemicalCompound:818540
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:818540
chemicalCompound:topical
No
lld:chembl
chemicalCompound:818540
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:818540
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:818540
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:818540
chemicalCompound:activity
activity:3945798
lld:chembl
chemicalCompound:818540
chemicalCompound:activity
activity:4722794
lld:chembl
chemicalCompound:818540
chemicalCompound:activity
activity:7291841
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:818540
lld:chembl