Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H23FN6O3S |
| Molecular Weight | 470.52 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H](OC1=C(N)N=CC(=C1)C2=C(C)N=C(S2)[C@](C)(O)CO)C3=C(C=CC(F)=C3)N4N=CC=N4
InChI
InChIKey=DIXMBHMNEHPFCX-MCMMXHMISA-N
InChI=1S/C22H23FN6O3S/c1-12-19(33-21(28-12)22(3,31)11-30)14-8-18(20(24)25-10-14)32-13(2)16-9-15(23)4-5-17(16)29-26-6-7-27-29/h4-10,13,30-31H,11H2,1-3H3,(H2,24,25)/t13-,22-/m1/s1
| Molecular Formula | C22H23FN6O3S |
| Molecular Weight | 470.52 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:13:18 UTC 2023
by
admin
on
Sat Dec 16 09:13:18 UTC 2023
|
| Record UNII |
76PND635L1
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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1549629-82-4
Created by
admin on Sat Dec 16 09:13:18 UTC 2023 , Edited by admin on Sat Dec 16 09:13:18 UTC 2023
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PRIMARY | |||
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72710568
Created by
admin on Sat Dec 16 09:13:18 UTC 2023 , Edited by admin on Sat Dec 16 09:13:18 UTC 2023
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PRIMARY | |||
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76PND635L1
Created by
admin on Sat Dec 16 09:13:18 UTC 2023 , Edited by admin on Sat Dec 16 09:13:18 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
TARGET -> INHIBITOR |
Ki
|
||
|
TARGET -> INHIBITOR | |||
|
TARGET -> INHIBITOR |
cellular assay
IC50
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ACTIVE MOIETY |
