Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H14Cl3N5O |
| Molecular Weight | 398.674 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@@H]1CN2C(=N1)C3=C(NC(=N3)C4=CC(Cl)=CC(Cl)=C4Cl)N(C)C2=O
InChI
InChIKey=YYDHUJWLNPIBDS-MRVPVSSYSA-N
InChI=1S/C16H14Cl3N5O/c1-3-8-6-24-15(20-8)12-14(23(2)16(24)25)22-13(21-12)9-4-7(17)5-10(18)11(9)19/h4-5,8H,3,6H2,1-2H3,(H,21,22)/t8-/m1/s1
| Molecular Formula | C16H14Cl3N5O |
| Molecular Weight | 398.674 |
| 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 19:12:02 UTC 2023
by
admin
on
Sat Dec 16 19:12:02 UTC 2023
|
| Record UNII |
2DRZ23E4F7
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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2DRZ23E4F7
Created by
admin on Sat Dec 16 19:12:02 UTC 2023 , Edited by admin on Sat Dec 16 19:12:02 UTC 2023
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PRIMARY | |||
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439902-54-2
Created by
admin on Sat Dec 16 19:12:02 UTC 2023 , Edited by admin on Sat Dec 16 19:12:02 UTC 2023
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PRIMARY | |||
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PSB-10
Created by
admin on Sat Dec 16 19:12:02 UTC 2023 , Edited by admin on Sat Dec 16 19:12:02 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
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TARGET -> INHIBITOR |
Ki
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TARGET->INVERSE AGONIST |
[35S]GTPγS binding assay using hA3-CHO-cells indicated that PSB-10 acts as an inverse agonist (IC50 = 4 nM).
IC50
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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