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622126
Source:
http://linkedlifedata.com/resource/chembl/compound/622126
Search
Subject
Predicate
Object
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(
42
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:622126
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:622126
chemicalCompound:standardIn...
InChI=1S/C22H27ClO5S/c1-3-12-4-6-13(7-5-12)8-14-9-15(17(28-2)10-16(14)23)22-21(27)20(26)19(25)18(11-24)29-22/h4-7,9-10,18-22,24-27H,3,8,11H2,1-2H3/t18-,19-,20+,21-,22+/m1/s1
lld:chembl
chemicalCompound:622126
chemicalCompound:standardIn...
ZCUPHXMNGVNWAQ-BDHVOXNPSA-N
lld:chembl
chemicalCompound:622126
chemicalCompound:canonicalS...
CCc1ccc(Cc2cc([C@@H]3S[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)cc2Cl)cc1
lld:chembl
chemicalCompound:622126
chemicalCompound:molecularF...
C22H27ClO5S
lld:chembl
chemicalCompound:622126
chemicalCompound:moleculeId
622126
lld:chembl
chemicalCompound:622126
chemicalCompound:mwFreebase
438.965
lld:chembl
chemicalCompound:622126
chemicalCompound:alogp
3.748
lld:chembl
chemicalCompound:622126
chemicalCompound:hba
6
lld:chembl
chemicalCompound:622126
chemicalCompound:hbd
4
lld:chembl
chemicalCompound:622126
chemicalCompound:psa
115.45
lld:chembl
chemicalCompound:622126
chemicalCompound:rtb
6
lld:chembl
chemicalCompound:622126
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:622126
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:622126
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:622126
chemicalCompound:acdMostApk...
13.132
lld:chembl
chemicalCompound:622126
chemicalCompound:acdLogP
5.782
lld:chembl
chemicalCompound:622126
chemicalCompound:acdLogD
5.782
lld:chembl
chemicalCompound:622126
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:622126
chemicalCompound:fullMwt
438.965
lld:chembl
chemicalCompound:622126
chemicalCompound:chemblId
CHEMBL1090786
lld:chembl
chemicalCompound:622126
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:622126
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:622126
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:622126
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:622126
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:622126
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:622126
chemicalCompound:oral
No
lld:chembl
chemicalCompound:622126
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:622126
chemicalCompound:topical
No
lld:chembl
chemicalCompound:622126
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:622126
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:622126
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257508
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257514
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257520
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257525
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257545
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257565
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257602
lld:chembl
chemicalCompound:622126
chemicalCompound:activity
activity:3257609
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:622126
lld:chembl