Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C9H16NO.I |
| Molecular Weight | 281.1339 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[I-].CC1=CC=C(C[N+](C)(C)C)O1
InChI
InChIKey=IHTCZSNKQINGDD-UHFFFAOYSA-M
InChI=1S/C9H16NO.HI/c1-8-5-6-9(11-8)7-10(2,3)4;/h5-6H,7H2,1-4H3;1H/q+1;/p-1
| Molecular Formula | HI |
| Molecular Weight | 127.91241 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C9H16NO |
| Molecular Weight | 154.2294 |
| Charge | 1 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL211 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18543900 |
6.02 null [pKi] | ||
Target ID: CHEMBL245 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18543900 |
5.21 null [pKi] | ||
Target ID: CHEMBL1821 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18543900 |
5.2 null [pKi] | ||
Target ID: CHEMBL2035 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18543900 |
5.16 null [pKi] | ||
Target ID: CHEMBL216 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18543900 |
5.1 null [pKi] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 19:58:50 GMT 2025
by
admin
on
Tue Apr 01 19:58:50 GMT 2025
|
| Record UNII |
TBP7263XX5
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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| Name | Type | Language | ||
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Common Name | English | ||
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Preferred Name | English | ||
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| Code System | Code | Type | Description | ||
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70973
Created by
admin on Tue Apr 01 19:58:50 GMT 2025 , Edited by admin on Tue Apr 01 19:58:50 GMT 2025
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DTXSID90923072
Created by
admin on Tue Apr 01 19:58:50 GMT 2025 , Edited by admin on Tue Apr 01 19:58:50 GMT 2025
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1197-60-0
Created by
admin on Tue Apr 01 19:58:50 GMT 2025 , Edited by admin on Tue Apr 01 19:58:50 GMT 2025
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34095
Created by
admin on Tue Apr 01 19:58:50 GMT 2025 , Edited by admin on Tue Apr 01 19:58:50 GMT 2025
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TBP7263XX5
Created by
admin on Tue Apr 01 19:58:50 GMT 2025 , Edited by admin on Tue Apr 01 19:58:50 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
|