Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C21H30N2O4.ClH |
| Molecular Weight | 410.935 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CC(C)N(CCC1=CNC2=C1C(OC(=O)CCCC(O)=O)=CC=C2)C(C)C
InChI
InChIKey=KGTHNSPZFZGCGX-UHFFFAOYSA-N
InChI=1S/C21H30N2O4.ClH/c1-14(2)23(15(3)4)12-11-16-13-22-17-7-5-8-18(21(16)17)27-20(26)10-6-9-19(24)25;/h5,7-8,13-15,22H,6,9-12H2,1-4H3,(H,24,25);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 | C21H30N2O4 |
| Molecular Weight | 374.4739 |
| 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: P28223 Gene ID: 3356.0 Gene Symbol: HTR2A Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/27216487 |
93.0 nM [EC50] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 18:03:53 GMT 2025
by
admin
on
Wed Apr 02 18:03:53 GMT 2025
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| Record UNII |
99Z3SJY4GD
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Code | English |
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2756001-46-2
Created by
admin on Wed Apr 02 18:03:53 GMT 2025 , Edited by admin on Wed Apr 02 18:03:53 GMT 2025
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99Z3SJY4GD
Created by
admin on Wed Apr 02 18:03:53 GMT 2025 , Edited by admin on Wed Apr 02 18:03:53 GMT 2025
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PRIMARY |
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ACTIVE MOIETY |
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