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Sources
33
Source:
http://linkedlifedata.com/resource/chembl/compound/33
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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:33
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:33
chemicalCompound:standardIn...
InChI=1S/C18H21N5O4S2/c1-26-14-10-12-13(11-15(14)27-2)20-18(21-17(12)19)22-5-7-23(8-6-22)29(24,25)16-4-3-9-28-16/h3-4,9-11H,5-8H2,1-2H3,(H2,19,20,21)
lld:chembl
chemicalCompound:33
chemicalCompound:standardIn...
RYVAEGMROPOPOW-UHFFFAOYSA-N
lld:chembl
chemicalCompound:33
chemicalCompound:canonicalS...
COc1cc2nc(nc(N)c2cc1OC)N3CCN(CC3)S(=O)(=O)c4cccs4
lld:chembl
chemicalCompound:33
chemicalCompound:molecularF...
C18 H21 N5 O4 S2
lld:chembl
chemicalCompound:33
chemicalCompound:moleculeId
33
lld:chembl
chemicalCompound:33
chemicalCompound:mwFreebase
435.52
lld:chembl
chemicalCompound:33
chemicalCompound:alogp
1.581
lld:chembl
chemicalCompound:33
chemicalCompound:hba
8
lld:chembl
chemicalCompound:33
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:33
chemicalCompound:psa
147.5
lld:chembl
chemicalCompound:33
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:33
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:33
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:33
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:33
chemicalCompound:acdLogP
3.637
lld:chembl
chemicalCompound:33
chemicalCompound:acdLogD
3.587
lld:chembl
chemicalCompound:33
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:33
chemicalCompound:fullMwt
435.52
lld:chembl
chemicalCompound:33
chemicalCompound:acdMostBpk...
6.495
lld:chembl
chemicalCompound:33
chemicalCompound:chemblId
CHEMBL112998
lld:chembl
chemicalCompound:33
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:33
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:33
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:33
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:33
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:33
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:33
chemicalCompound:oral
No
lld:chembl
chemicalCompound:33
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:33
chemicalCompound:topical
No
lld:chembl
chemicalCompound:33
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:33
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:33
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:33
chemicalCompound:activity
activity:343861
lld:chembl
chemicalCompound:33
chemicalCompound:activity
activity:343862
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:33
lld:chembl