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143470
Source:
http://linkedlifedata.com/resource/chembl/compound/143470
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Subject
(
35
)
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Inference
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Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C17H13Cl2NO5S/c1-2-10-5-3-8-13-14(10)16(21)20(26(13,23)24)9-25-17(22)15-11(18)6-4-7-12(15)19/h3-8H,2,9H2,1H3
chemicalCompound:standardIn...
HUJCZKNTSFAMTH-UHFFFAOYSA-N
chemicalCompound:canonicalS...
CCc1cccc2c1C(=O)N(COC(=O)c3c(Cl)cccc3Cl)S2(=O)=O
chemicalCompound:molecularF...
C17 H13 Cl2 N O5 S
chemicalCompound:moleculeId
143470
chemicalCompound:mwFreebase
414.26
chemicalCompound:alogp
4.322
chemicalCompound:hba
5
chemicalCompound:hbd
0
chemicalCompound:psa
89.13
chemicalCompound:rtb
5
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
4.428
chemicalCompound:acdLogD
4.428
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
414.26
chemicalCompound:chemblId
CHEMBL432049
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:243470
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:39571
,
activity:39572
,
activity:1238661