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Sources
161618
Source:
http://linkedlifedata.com/resource/chembl/compound/161618
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Subject
(
34
)
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
chemicalCompound:standardIn...
InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)
chemicalCompound:standardIn...
RWSXRVCMGQZWBV-UHFFFAOYSA-N
chemicalCompound:canonicalS...
NC(CCC(=O)NC(CS)C(=O)NCC(=O)O)C(=O)O
chemicalCompound:molecularF...
C10H17N3O6S
chemicalCompound:moleculeId
161618
chemicalCompound:mwFreebase
307.323
chemicalCompound:alogp
-4.772
chemicalCompound:hba
8
chemicalCompound:hbd
6
chemicalCompound:psa
197.61
chemicalCompound:rtb
9
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
1
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
2.214
chemicalCompound:acdLogP
-1.645
chemicalCompound:acdLogD
-5.154
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
chemicalCompound:fullMwt
307.323
chemicalCompound:acdMostBpk...
9.301
chemicalCompound:chemblId
CHEMBL100476
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:261618
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
CYSTEINE