Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C11H16BrNO2.ClH |
| Molecular Weight | 310.615 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC(Br)=C(OC)C=C1C[C@@H](C)N
InChI
InChIKey=SPBBKPOIDQIWDZ-OGFXRTJISA-N
InChI=1S/C11H16BrNO2.ClH/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2;/h5-7H,4,13H2,1-3H3;1H/t7-;/m1./s1
| 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 | C11H16BrNO2 |
| Molecular Weight | 274.154 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
| 0.29 nM [Ki] | |||
Target ID: CHEMBL2093870 Sources: https://www.ncbi.nlm.nih.gov/pubmed/3572981 |
0.39 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:10:24 GMT 2025
by
admin
on
Mon Mar 31 23:10:24 GMT 2025
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| Record UNII |
90EJB60I5A
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| Record Status |
Validated (UNII)
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| Record Version |
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50505-92-5
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60196332
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90EJB60I5A
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DTXSID6048882
Created by
admin on Mon Mar 31 23:10:24 GMT 2025 , Edited by admin on Mon Mar 31 23:10:24 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
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