Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H18F2N4O |
| Molecular Weight | 320.3371 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@H]1C[C@H](CO[C@@H]1C2=CC(F)=CC=C2F)N3CC4=C(C3)C=NN4
InChI
InChIKey=JFUBTJMMAHQVJI-DIOULYMOSA-N
InChI=1S/C16H18F2N4O/c17-10-1-2-13(18)12(3-10)16-14(19)4-11(8-23-16)22-6-9-5-20-21-15(9)7-22/h1-3,5,11,14,16H,4,6-8,19H2,(H,20,21)/t11-,14+,16-/m1/s1
| Molecular Formula | C16H18F2N4O |
| Molecular Weight | 320.3371 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 21:21:08 GMT 2025
by
admin
on
Wed Apr 02 21:21:08 GMT 2025
|
| Record UNII |
JDY68RMF44
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Preferred Name | English |
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951127-17-6
Created by
admin on Wed Apr 02 21:21:08 GMT 2025 , Edited by admin on Wed Apr 02 21:21:08 GMT 2025
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1819364-01-6
Created by
admin on Wed Apr 02 21:21:08 GMT 2025 , Edited by admin on Wed Apr 02 21:21:08 GMT 2025
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24769723
Created by
admin on Wed Apr 02 21:21:08 GMT 2025 , Edited by admin on Wed Apr 02 21:21:08 GMT 2025
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JDY68RMF44
Created by
admin on Wed Apr 02 21:21:08 GMT 2025 , Edited by admin on Wed Apr 02 21:21:08 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
IC50
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| Related Record | Type | Details | ||
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ACTIVE MOIETY |
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![Structure of (2R,3S,5R)-2-(2,5-Difluorophenyl)-5-(4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl)tetrahydro-2H-pyran-3-amine](/img/3a574091-ec17-47a9-9d4c-b2f0f568d7c2.svg "Structure of (2R,3S,5R)-2-(2,5-Difluorophenyl)-5-(4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl)tetrahydro-2H-pyran-3-amine")