Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C18H22F2N4O |
| Molecular Weight | 348.3903 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(CCCN1CCN(CC1)C2=NC=C(F)C=N2)C3=CC=C(F)C=C3
InChI
InChIKey=ZXUYYZPJUGQHLQ-UHFFFAOYSA-N
InChI=1S/C18H22F2N4O/c19-15-5-3-14(4-6-15)17(25)2-1-7-23-8-10-24(11-9-23)18-21-12-16(20)13-22-18/h3-6,12-13,17,25H,1-2,7-11H2
| Molecular Formula | C18H22F2N4O |
| Molecular Weight | 348.3903 |
| 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: Q99720|||Q7Z653 Gene ID: 10280.0 Gene Symbol: SIGMAR1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/11784148 |
265.0 nM [Ki] | ||
Target ID: Q5BJF2 Gene ID: 27346.0 Gene Symbol: TMEM97 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/11784148 |
391.0 nM [Ki] |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:01:30 GMT 2025
by
admin
on
Mon Mar 31 22:01:30 GMT 2025
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| Record UNII |
A5NB5G07JO
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| Record Status |
Validated (UNII)
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| Record Version |
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DTXSID70909596
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105565-56-8
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BMY-14802
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A5NB5G07JO
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108046
Created by
admin on Mon Mar 31 22:01:30 GMT 2025 , Edited by admin on Mon Mar 31 22:01:30 GMT 2025
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| Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT |
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ACTIVE MOIETY |