Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C11H15NO.ClH |
| Molecular Weight | 213.704 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCNC(C)C(=O)C1=CC=CC=C1
InChI
InChIKey=XCVDYVFUJZVVKL-UHFFFAOYSA-N
InChI=1S/C11H15NO.ClH/c1-3-12-9(2)11(13)10-7-5-4-6-8-10;/h4-9,12H,3H2,1-2H3;1H
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.2429 |
| 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: CHEMBL238 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11131159 |
1014.0 nM [IC50] | ||
Target ID: CHEMBL228 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11131159 |
3840.0 nM [IC50] | ||
Target ID: CHEMBL222 Sources: https://www.ncbi.nlm.nih.gov/pubmed/11131159 |
360.0 nM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 11:39:48 GMT 2025
by
admin
on
Wed Apr 02 11:39:48 GMT 2025
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| Record UNII |
SQ59TT7X5R
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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458518
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admin on Wed Apr 02 11:39:48 GMT 2025 , Edited by admin on Wed Apr 02 11:39:48 GMT 2025
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PRIMARY | PUBCHEM | ||
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300000051560
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SQ59TT7X5R
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51553-17-4
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DTXSID10332526
Created by
admin on Wed Apr 02 11:39:48 GMT 2025 , Edited by admin on Wed Apr 02 11:39:48 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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