Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C21H26ClN3O2.2ClH |
| Molecular Weight | 460.825 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.NC(=O)COCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(Cl)C=C3
InChI
InChIKey=ASDFTQNLTBVBQC-UHFFFAOYSA-N
InChI=1S/C21H26ClN3O2.2ClH/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)25-12-10-24(11-13-25)14-15-27-16-20(23)26;;/h1-9,21H,10-16H2,(H2,23,26);2*1H
| Molecular Formula | C21H26ClN3O2 |
| Molecular Weight | 387.903 |
| 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: CHEMBL379 Sources: https://www.ncbi.nlm.nih.gov/pubmed/26599718 |
103.0 nM [EC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:04:09 GMT 2025
by
admin
on
Mon Mar 31 22:04:09 GMT 2025
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| Record UNII |
6RX79524H2
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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200707-85-3
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6RX79524H2
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60196365
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admin on Mon Mar 31 22:04:09 GMT 2025 , Edited by admin on Mon Mar 31 22:04:09 GMT 2025
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DTXSID2049052
Created by
admin on Mon Mar 31 22:04:09 GMT 2025 , Edited by admin on Mon Mar 31 22:04:09 GMT 2025
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