Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C24H22F7N7O3 |
| Molecular Weight | 589.4654 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
FC1=C(C=CC(OCCCC(F)(F)F)=C1)[C@@]2(CC(C3=NN(CC4CC4)C=C3)=C(N5N=NNC5=O)C(=O)N2)C(F)(F)F
InChI
InChIKey=VFFPVFKSCNJAMO-QFIPXVFZSA-N
InChI=1S/C24H22F7N7O3/c25-17-10-14(41-9-1-7-23(26,27)28)4-5-16(17)22(24(29,30)31)11-15(18-6-8-37(34-18)12-13-2-3-13)19(20(39)32-22)38-21(40)33-35-36-38/h4-6,8,10,13H,1-3,7,9,11-12H2,(H,32,39)(H,33,36,40)/t22-/m0/s1
| Molecular Formula | C24H22F7N7O3 |
| Molecular Weight | 589.4654 |
| 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 18:30:07 GMT 2023
by
admin
on
Sat Dec 16 18:30:07 GMT 2023
|
| Record UNII |
E9L8QD5F8B
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Code | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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E9L8QD5F8B
Created by
admin on Sat Dec 16 18:30:07 GMT 2023 , Edited by admin on Sat Dec 16 18:30:07 GMT 2023
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PRIMARY | |||
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1808258-99-2
Created by
admin on Sat Dec 16 18:30:07 GMT 2023 , Edited by admin on Sat Dec 16 18:30:07 GMT 2023
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PRIMARY | |||
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136970071
Created by
admin on Sat Dec 16 18:30:07 GMT 2023 , Edited by admin on Sat Dec 16 18:30:07 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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OFF TARGET->WEAK INHIBITOR |
IC50 values against recombinant human DGAT1, DGAT2,MGAT1,AWAT1,AWAT2,DC3,ACAT1,and ACAT2 were above 30μM.
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TARGET -> INHIBITOR |
Selective against MAGA2
IC50
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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