Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C9H11N |
| Molecular Weight | 133.1903 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H]1C[C@@H]1C2=CC=CC=C2
InChI
InChIKey=AELCINSCMGFISI-RKDXNWHRSA-N
InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9-/m1/s1
| Molecular Formula | C9H11N |
| Molecular Weight | 133.1903 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL2039 |
4.02 µM [IC50] | ||
Target ID: GO:0003774 Sources: https://www.ncbi.nlm.nih.gov/pubmed/31254 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:35:57 GMT 2025
by
admin
on
Mon Mar 31 22:35:57 GMT 2025
|
| Record UNII |
HXA9ID52RQ
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Code System | Code | Type | Description | ||
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6971118
Created by
admin on Mon Mar 31 22:35:57 GMT 2025 , Edited by admin on Mon Mar 31 22:35:57 GMT 2025
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HXA9ID52RQ
Created by
admin on Mon Mar 31 22:35:57 GMT 2025 , Edited by admin on Mon Mar 31 22:35:57 GMT 2025
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DTXSID80159308
Created by
admin on Mon Mar 31 22:35:57 GMT 2025 , Edited by admin on Mon Mar 31 22:35:57 GMT 2025
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13531-35-6
Created by
admin on Mon Mar 31 22:35:57 GMT 2025 , Edited by admin on Mon Mar 31 22:35:57 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT |
| Related Record | Type | Details | ||
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PARENT -> IMPURITY | |||
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PARENT -> IMPURITY |