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1285935
Source:
http://linkedlifedata.com/resource/chembl/compound/1285935
Search
Subject
(
100
of
many
)
Predicate
Object
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C11H10N4O3S/c16-10(12-6-8-4-2-1-3-5-8)14-11-13-7-9(19-11)15(17)18/h1-5,7H,6H2,(H2,12,13,14,16)
chemicalCompound:standardIn...
CKDGJQLBXUOVSI-UHFFFAOYSA-N
chemicalCompound:canonicalS...
[O-][N+](=O)c1cnc(NC(=O)NCc2ccccc2)s1
chemicalCompound:molecularF...
C11H10N4O3S
chemicalCompound:moleculeId
1285935
chemicalCompound:mwFreebase
278.287
chemicalCompound:alogp
1.545
chemicalCompound:hba
4
chemicalCompound:hbd
2
chemicalCompound:psa
128.08
chemicalCompound:rtb
4
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
5.028
chemicalCompound:acdLogP
3.477
chemicalCompound:acdLogD
1.688
chemicalCompound:molecularS...
molecularSpecies:ACID
chemicalCompound:fullMwt
278.287
chemicalCompound:chemblId
CHEMBL1964644
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:1385935
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity
activity:9507445
,
activity:9512041
,
activity:9519364
,
activity:9519965
,
activity:9520186
,
activity:9520455
,
activity:9520676
,
activity:9523710
,
activity:9524042
,
activity:9532552
,
activity:9532687
,
activity:9532776
,
activity:9532888
,
activity:9533252
,
activity:9535948
,
activity:9536205
,
activity:9536468
,
activity:9539845
,
activity:9544759
,
activity:9545008
,
activity:9545342
,
activity:9549298
,
activity:9552126
,
activity:9552701
,
activity:9557251
,
activity:9557640
,
activity:9557782
,
activity:9560805
,
activity:9561012
,
activity:9561373
,
activity:9565686
,
activity:9568752
,
activity:9570153
,
activity:9570269
,
activity:9572125
,
activity:9573417
,
activity:9574754
,
activity:9574856
,
activity:9575124
,
activity:9575482
,
activity:9576135
,
activity:9576488
,
activity:9577108
,
activity:9577602
,
activity:9578152
,
activity:9578343
,
activity:9579578
,
activity:9581641
,
activity:9582677
,
activity:9583077
,
activity:9583624
,
activity:9584114
,
activity:9584496
,
activity:9584868
,
activity:9586616
,
activity:9587470
,
activity:9589074
,
activity:9589214
,
activity:9589965
,
activity:9591973
,
activity:9593375
,
activity:9593468
,
activity:9594404
,
activity:9594727
,
activity:9595190
,
activity:9596309
,
activity:9597637
More...