Details
Stereochemistry | ACHIRAL |
Molecular Formula | C5H9N3.2ClH |
Molecular Weight | 184.067 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.NCCC1=NNC=C1
InChI
InChIKey=BUXCUOWXTOKEMQ-UHFFFAOYSA-N
InChI=1S/C5H9N3.2ClH/c6-3-1-5-2-4-7-8-5;;/h2,4H,1,3,6H2,(H,7,8);2*1H
Molecular Formula | ClH |
Molecular Weight | 36.461 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C5H9N3 |
Molecular Weight | 111.1451 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Overview
CYP3A4 | CYP2C9 | CYP2D6 | hERG |
---|---|---|---|
OverviewOther
Other Inhibitor | Other Substrate | Other Inducer |
---|---|---|
Drug as perpetrator​
Target | Modality | Activity | Metabolite | Clinical evidence |
---|---|---|---|---|
Sources: https://pubmed.ncbi.nlm.nih.gov/466870/ |
yes |
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:22:34 GMT 2023
by
admin
on
Fri Dec 15 15:22:34 GMT 2023
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Record UNII |
66ABP6C83F
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C1937
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admin on Fri Dec 15 15:22:34 GMT 2023 , Edited by admin on Fri Dec 15 15:22:34 GMT 2023
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CHEMBL1201323
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DTXSID6047789
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31280
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DBSALT000898
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138-92-1
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759872
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205-345-2
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m2455
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67412
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SUB00789MIG
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66ABP6C83F
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C65259
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100000085005
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |