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269612
Source:
http://linkedlifedata.com/resource/chembl/compound/269612
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Subject
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:269612
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:269612
chemicalCompound:standardIn...
InChI=1S/C24H30N2O4S/c1-24(2,3)17-9-11-18(12-10-17)30-19-7-4-6-16(14-19)22-26(21(27)15-31-22)20(23(28)29)8-5-13-25/h4,6-7,9-12,14,20,22H,5,8,13,15,25H2,1-3H3,(H,28,29)/t20-,22?/m0/s1
lld:chembl
chemicalCompound:269612
chemicalCompound:standardIn...
MNVWQMPWGSHTHZ-AIBWNMTMSA-N
lld:chembl
chemicalCompound:269612
chemicalCompound:canonicalS...
CC(C)(C)c1ccc(Oc2cccc(c2)C3SCC(=O)N3[C@@H](CCCN)C(=O)O)cc1
lld:chembl
chemicalCompound:269612
chemicalCompound:molecularF...
C24 H30 N2 O4 S
lld:chembl
chemicalCompound:269612
chemicalCompound:moleculeId
269612
lld:chembl
chemicalCompound:269612
chemicalCompound:mwFreebase
442.571
lld:chembl
chemicalCompound:269612
chemicalCompound:alogp
1.574
lld:chembl
chemicalCompound:269612
chemicalCompound:hba
6
lld:chembl
chemicalCompound:269612
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:269612
chemicalCompound:psa
118.16
lld:chembl
chemicalCompound:269612
chemicalCompound:rtb
9
lld:chembl
chemicalCompound:269612
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:269612
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:269612
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:269612
chemicalCompound:acdMostApk...
3.61
lld:chembl
chemicalCompound:269612
chemicalCompound:acdLogP
7.669
lld:chembl
chemicalCompound:269612
chemicalCompound:acdLogD
5.168
lld:chembl
chemicalCompound:269612
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
lld:chembl
chemicalCompound:269612
chemicalCompound:fullMwt
442.571
lld:chembl
chemicalCompound:269612
chemicalCompound:acdMostBpk...
10.52
lld:chembl
chemicalCompound:269612
chemicalCompound:chemblId
CHEMBL348928
lld:chembl
chemicalCompound:269612
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:269612
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:269612
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:269612
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:269612
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:269612
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:269612
chemicalCompound:oral
No
lld:chembl
chemicalCompound:269612
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:269612
chemicalCompound:topical
No
lld:chembl
chemicalCompound:269612
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:269612
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:269612
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:269612
chemicalCompound:activity
activity:654639
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:269612
lld:chembl