Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C14H16F3N7 |
| Molecular Weight | 339.3189 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNC1=NC(NC2=CN(N=C2C)C(C)(C)C#N)=NC=C1C(F)(F)F
InChI
InChIKey=ZPPUMAMZIMPJGP-UHFFFAOYSA-N
InChI=1S/C14H16F3N7/c1-8-10(6-24(23-8)13(2,3)7-18)21-12-20-5-9(14(15,16)17)11(19-4)22-12/h5-6H,1-4H3,(H2,19,20,21,22)
| Molecular Formula | C14H16F3N7 |
| Molecular Weight | 339.3189 |
| 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 14:00:12 UTC 2023
by
admin
on
Sat Dec 16 14:00:12 UTC 2023
|
| Record UNII |
ANGHS285FG
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Code | English | ||
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| Code System | Code | Type | Description | ||
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69093374
Created by
admin on Sat Dec 16 14:00:13 UTC 2023 , Edited by admin on Sat Dec 16 14:00:13 UTC 2023
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PRIMARY | |||
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ANGHS285FG
Created by
admin on Sat Dec 16 14:00:13 UTC 2023 , Edited by admin on Sat Dec 16 14:00:13 UTC 2023
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PRIMARY | |||
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1374828-69-9
Created by
admin on Sat Dec 16 14:00:13 UTC 2023 , Edited by admin on Sat Dec 16 14:00:13 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
METABOLIC ENZYME -> INDUCER | |||
|
METABOLIC ENZYME -> INDUCER | |||
|
METABOLIC ENZYME -> INHIBITOR |
IC50
|
||
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TARGET -> INHIBITOR |
IC50
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||
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TRANSPORTER -> NON-SUBSTRATE | |||
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METABOLIC ENZYME -> INDUCER |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
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ACTIVE MOIETY |
| Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
|---|---|---|---|---|---|---|
| CSF/PLASMA RATIO | PHARMACOKINETIC |
|