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563508
Source:
http://linkedlifedata.com/resource/chembl/compound/563508
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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:563508
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:563508
chemicalCompound:standardIn...
InChI=1S/C14H19N5O5S/c15-7(14(22)23)1-2-25-4-9-10(20)11(21)13(24-9)19-6-18-8-3-16-5-17-12(8)19/h3,5-7,9-11,13,20-21H,1-2,4,15H2,(H,22,23)/t7-,9+,10+,11+,13+/m0/s1
lld:chembl
chemicalCompound:563508
chemicalCompound:standardIn...
PBQISZQQRZEGMN-ARYVQYHZSA-N
lld:chembl
chemicalCompound:563508
chemicalCompound:canonicalS...
N[C@H](CCSC[C@@H]1O[C@H]([C@@H](O)[C@@H]1O)n2cnc3cncnc23)C(=O)O
lld:chembl
chemicalCompound:563508
chemicalCompound:molecularF...
C14H19N5O5S
lld:chembl
chemicalCompound:563508
chemicalCompound:moleculeId
563508
lld:chembl
chemicalCompound:563508
chemicalCompound:mwFreebase
369.396
lld:chembl
chemicalCompound:563508
chemicalCompound:alogp
-4.149
lld:chembl
chemicalCompound:563508
chemicalCompound:hba
10
lld:chembl
chemicalCompound:563508
chemicalCompound:hbd
4
lld:chembl
chemicalCompound:563508
chemicalCompound:psa
181.9
lld:chembl
chemicalCompound:563508
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:563508
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:563508
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:563508
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:563508
chemicalCompound:acdMostApk...
2.223
lld:chembl
chemicalCompound:563508
chemicalCompound:acdLogP
-0.79
lld:chembl
chemicalCompound:563508
chemicalCompound:acdLogD
-3.295
lld:chembl
chemicalCompound:563508
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
lld:chembl
chemicalCompound:563508
chemicalCompound:fullMwt
369.396
lld:chembl
chemicalCompound:563508
chemicalCompound:acdMostBpk...
9.474
lld:chembl
chemicalCompound:563508
chemicalCompound:chemblId
CHEMBL563570
lld:chembl
chemicalCompound:563508
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:563508
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:563508
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:563508
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:563508
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:563508
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:563508
chemicalCompound:oral
No
lld:chembl
chemicalCompound:563508
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:563508
chemicalCompound:topical
No
lld:chembl
chemicalCompound:563508
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:563508
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:563508
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:563508
chemicalCompound:activity
activity:2676537
lld:chembl
chemicalCompound:563508
chemicalCompound:activity
activity:2676558
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:563508
lld:chembl