Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C20H24F3N3O2 |
| Molecular Weight | 395.4187 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NC(=O)C1=CC(F)=CC2=C1C(=O)N(C2)C3CCN(CC3)C4CCC(F)(F)CC4
InChI
InChIKey=ARYVAQSYRLZVQD-UHFFFAOYSA-N
InChI=1S/C20H24F3N3O2/c21-13-9-12-11-26(19(28)17(12)16(10-13)18(24)27)15-3-7-25(8-4-15)14-1-5-20(22,23)6-2-14/h9-10,14-15H,1-8,11H2,(H2,24,27)
| Molecular Formula | C20H24F3N3O2 |
| Molecular Weight | 395.4187 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 15:57:38 GMT 2023
by
admin
on
Sat Dec 16 15:57:38 GMT 2023
|
| Record UNII |
9TSU9SA6UZ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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| Code System | Code | Type | Description | ||
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1262417-51-5
Created by
admin on Sat Dec 16 15:57:38 GMT 2023 , Edited by admin on Sat Dec 16 15:57:38 GMT 2023
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49843531
Created by
admin on Sat Dec 16 15:57:38 GMT 2023 , Edited by admin on Sat Dec 16 15:57:38 GMT 2023
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PRIMARY | |||
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9TSU9SA6UZ
Created by
admin on Sat Dec 16 15:57:38 GMT 2023 , Edited by admin on Sat Dec 16 15:57:38 GMT 2023
|
PRIMARY |
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TARGET -> INHIBITOR |
Ability
to inhibit proliferation of MDA-MB-436, a triple negative
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IC50
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OFF TARGET->NON-INHIBITOR |
Kd
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