Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C11H13NO.ClH |
| Molecular Weight | 211.688 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(N)CC1=CC2=C(C=CO2)C=C1
InChI
InChIKey=APEWOTOLPKNSPE-UHFFFAOYSA-N
InChI=1S/C11H13NO.ClH/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9;/h2-5,7-8H,6,12H2,1H3;1H
| Molecular Formula | C11H13NO |
| Molecular Weight | 175.227 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| 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 |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL222 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23261499 |
6.52 null [pKi] | ||
Target ID: CHEMBL238 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23261499 |
6.63 null [pKi] | ||
Target ID: CHEMBL228 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23261499 |
5.26 null [pKi] | ||
Target ID: CHEMBL323 Sources: https://www.ncbi.nlm.nih.gov/pubmed/23261499 |
3.7 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 13:26:32 GMT 2025
by
admin
on
Wed Apr 02 13:26:32 GMT 2025
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| Record UNII |
2427R9BH29
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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DTXSID20430784
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9794342
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admin on Wed Apr 02 13:26:32 GMT 2025 , Edited by admin on Wed Apr 02 13:26:32 GMT 2025
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2427R9BH29
Created by
admin on Wed Apr 02 13:26:32 GMT 2025 , Edited by admin on Wed Apr 02 13:26:32 GMT 2025
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286834-84-2
Created by
admin on Wed Apr 02 13:26:32 GMT 2025 , Edited by admin on Wed Apr 02 13:26:32 GMT 2025
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|---|---|---|---|---|
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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