Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C24H25N5O.2ClH |
| Molecular Weight | 472.41 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.C(CN1CCCCC1)OC2=CC=C(C=C2)C3=CN4N=CC(=C4N=C3)C5=CC=NC=C5
InChI
InChIKey=RJDVIJJQKMGPMV-UHFFFAOYSA-N
InChI=1S/C24H25N5O.2ClH/c1-2-12-28(13-3-1)14-15-30-22-6-4-19(5-7-22)21-16-26-24-23(17-27-29(24)18-21)20-8-10-25-11-9-20;;/h4-11,16-18H,1-3,12-15H2;2*1H
| Molecular Formula | C24H25N5O |
| Molecular Weight | 399.4882 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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: CHEMBL2068 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20932747 |
11.0 nM [IC50] | ||
Target ID: CHEMBL279 Sources: https://www.ncbi.nlm.nih.gov/pubmed/12443771 |
20.0 nM [IC50] | ||
Target ID: CHEMBL1868 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20932747 |
11.0 nM [IC50] | ||
Target ID: CHEMBL4718 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20932747 |
11.0 nM [IC50] | ||
Target ID: CHEMBL258 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20932747 |
16.0 nM [IC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 19:24:15 GMT 2025
by
admin
on
Wed Apr 02 19:24:15 GMT 2025
|
| Record UNII |
TD4NBA239W
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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Code | English |
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1219168-18-9
Created by
admin on Wed Apr 02 19:24:15 GMT 2025 , Edited by admin on Wed Apr 02 19:24:15 GMT 2025
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49761481
Created by
admin on Wed Apr 02 19:24:15 GMT 2025 , Edited by admin on Wed Apr 02 19:24:15 GMT 2025
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TD4NBA239W
Created by
admin on Wed Apr 02 19:24:15 GMT 2025 , Edited by admin on Wed Apr 02 19:24:15 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
|