Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C21H23ClN2O2.ClH |
| Molecular Weight | 407.333 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.COC1=CC=C(CC2NCCC3=C2NC4=CC=C(C)C=C34)C(Cl)=C1OC
InChI
InChIKey=KPXKZZURYAXZQE-UHFFFAOYSA-N
InChI=1S/C21H23ClN2O2.ClH/c1-12-4-6-16-15(10-12)14-8-9-23-17(20(14)24-16)11-13-5-7-18(25-2)21(26-3)19(13)22;/h4-7,10,17,23-24H,8-9,11H2,1-3H3;1H
| 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 | C21H23ClN2O2 |
| Molecular Weight | 370.873 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: CHEMBL224 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8709108 |
19.5 nM [Ki] | ||
Target ID: CHEMBL225 Sources: https://www.ncbi.nlm.nih.gov/pubmed/8709108 |
24.55 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 11:39:49 GMT 2025
by
admin
on
Wed Apr 02 11:39:49 GMT 2025
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| Record UNII |
W9Q5A842YM
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| Record Status |
Validated (UNII)
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| Record Version |
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DTXSID70433285
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9953184
Created by
admin on Wed Apr 02 11:39:49 GMT 2025 , Edited by admin on Wed Apr 02 11:39:49 GMT 2025
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|---|---|---|---|---|
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ACTIVE MOIETY |
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