Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H25ClFN7O2 |
| Molecular Weight | 473.931 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CN=C(NC2CCOCC2)N=C1N3C=NC(=C3)C(=O)N[C@H](CN)C4=CC(F)=CC(Cl)=C4
InChI
InChIKey=PWHIUQBBGPGFFV-GOSISDBHSA-N
InChI=1S/C22H25ClFN7O2/c1-13-10-26-22(28-17-2-4-33-5-3-17)30-20(13)31-11-19(27-12-31)21(32)29-18(9-25)14-6-15(23)8-16(24)7-14/h6-8,10-12,17-18H,2-5,9,25H2,1H3,(H,29,32)(H,26,28,30)/t18-/m1/s1
| Molecular Formula | C22H25ClFN7O2 |
| Molecular Weight | 473.931 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 23:16:52 GMT 2025
by
admin
on
Tue Apr 01 23:16:52 GMT 2025
|
| Record UNII |
6EEK33O4O4
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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6EEK33O4O4
Created by
admin on Tue Apr 01 23:16:52 GMT 2025 , Edited by admin on Tue Apr 01 23:16:52 GMT 2025
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2055597-12-9
Created by
admin on Tue Apr 01 23:16:52 GMT 2025 , Edited by admin on Tue Apr 01 23:16:52 GMT 2025
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124122366
Created by
admin on Tue Apr 01 23:16:52 GMT 2025 , Edited by admin on Tue Apr 01 23:16:52 GMT 2025
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PRIMARY |
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IC50
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SALT/SOLVATE -> PARENT |
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TARGET -> INHIBITOR |
IC50
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ACTIVE MOIETY |
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