Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H28F3N5O2S |
Molecular Weight | 543.604 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H](OC1=C(SC(=C1)N2C=NC3=CC=C(CN4CCN(C)CC4)C=C23)C(N)=O)C5=CC=CC=C5C(F)(F)F
InChI
InChIKey=ZHJGWYRLJUCMRT-QGZVFWFLSA-N
InChI=1S/C27H28F3N5O2S/c1-17(19-5-3-4-6-20(19)27(28,29)30)37-23-14-24(38-25(23)26(31)36)35-16-32-21-8-7-18(13-22(21)35)15-34-11-9-33(2)10-12-34/h3-8,13-14,16-17H,9-12,15H2,1-2H3,(H2,31,36)/t17-/m1/s1
Molecular Formula | C27H28F3N5O2S |
Molecular Weight | 543.604 |
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
Sat Dec 16 08:35:37 UTC 2023
by
admin
on
Sat Dec 16 08:35:37 UTC 2023
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Record UNII |
8QO27TK6Q4
|
Record Status |
Validated (UNII)
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Record Version |
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-
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C70948
Created by
admin on Sat Dec 16 08:35:37 UTC 2023 , Edited by admin on Sat Dec 16 08:35:37 UTC 2023
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8QO27TK6Q4
Created by
admin on Sat Dec 16 08:35:37 UTC 2023 , Edited by admin on Sat Dec 16 08:35:37 UTC 2023
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300000041494
Created by
admin on Sat Dec 16 08:35:37 UTC 2023 , Edited by admin on Sat Dec 16 08:35:37 UTC 2023
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15983966
Created by
admin on Sat Dec 16 08:35:37 UTC 2023 , Edited by admin on Sat Dec 16 08:35:37 UTC 2023
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929095-18-1
Created by
admin on Sat Dec 16 08:35:37 UTC 2023 , Edited by admin on Sat Dec 16 08:35:37 UTC 2023
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DTXSID60239197
Created by
admin on Sat Dec 16 08:35:37 UTC 2023 , Edited by admin on Sat Dec 16 08:35:37 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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TARGET -> INHIBITOR |
atp
COMPETITIVE INHIBITOR
IC50
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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