Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C15H18IN3O2 |
| Molecular Weight | 399.2268 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)NCC(O)COC1=C2C(NC(C#N)=C2I)=CC=C1
InChI
InChIKey=WGSPBWSPJOBKNT-UHFFFAOYSA-N
InChI=1S/C15H18IN3O2/c1-9(2)18-7-10(20)8-21-13-5-3-4-11-14(13)15(16)12(6-17)19-11/h3-5,9-10,18-20H,7-8H2,1-2H3
| Molecular Formula | C15H18IN3O2 |
| Molecular Weight | 399.2268 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 20:17:05 UTC 2023
by
admin
on
Sat Dec 16 20:17:05 UTC 2023
|
| Record UNII |
WP4LUA5RAK
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Common Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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68618
Created by
admin on Sat Dec 16 20:17:06 UTC 2023 , Edited by admin on Sat Dec 16 20:17:06 UTC 2023
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PRIMARY | |||
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83498-72-0
Created by
admin on Sat Dec 16 20:17:06 UTC 2023 , Edited by admin on Sat Dec 16 20:17:06 UTC 2023
|
PRIMARY | |||
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WP4LUA5RAK
Created by
admin on Sat Dec 16 20:17:06 UTC 2023 , Edited by admin on Sat Dec 16 20:17:06 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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TARGET -> INHIBITOR |
Chinese hamster ovary (CHO) cells stably expressing the three β-adrenergic receptor subtypes at comparable levels.
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LABELED -> NON-LABELED |
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|
TARGET -> INHIBITOR |
Chinese hamster ovary (CHO) cells stably expressing the three β-adrenergic receptor subtypes at comparable levels.
Kd
|
||
|
TARGET -> INHIBITOR |
Chinese hamster ovary (CHO) cells stably expressing the three β-adrenergic receptor subtypes at comparable levels.
Kd
|
