Details
| Stereochemistry | EPIMERIC |
| Molecular Formula | C30H34FN3O2 |
| Molecular Weight | 487.6083 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](NC(=O)C(C)(C)OC1=CC=C(C)C=N1)[C@@H](CC2=CC=C(CCCF)C=C2)C3=CC=CC(=C3)C#N
InChI
InChIKey=HSAFHGDBEOFPKT-WXVAWEFUSA-N
InChI=1S/C30H34FN3O2/c1-21-10-15-28(33-20-21)36-30(3,4)29(35)34-22(2)27(26-9-5-7-25(17-26)19-32)18-24-13-11-23(12-14-24)8-6-16-31/h5,7,9-15,17,20,22,27H,6,8,16,18H2,1-4H3,(H,34,35)/t22-,27+/m0/s1
| Molecular Formula | C32H38FN3O2 |
| Molecular Weight | 515.6614 |
| Charge | 0 |
| Count |
|
| Stereochemistry | EPIMERIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:50:30 GMT 2023
by
admin
on
Sat Dec 16 18:50:30 GMT 2023
|
| Record UNII |
7HQ54W9RYH
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Code | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
7HQ54W9RYH
Created by
admin on Sat Dec 16 18:50:31 GMT 2023 , Edited by admin on Sat Dec 16 18:50:31 GMT 2023
|
PRIMARY | |||
|
165412109
Created by
admin on Sat Dec 16 18:50:31 GMT 2023 , Edited by admin on Sat Dec 16 18:50:31 GMT 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
TARGET->INVERSE AGONIST |
IC50
|
||
|
LABELED -> NON-LABELED |
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ACTIVE MOIETY |
|
