Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C26H22N4O3 |
| Molecular Weight | 438.4779 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](N1C=C(C2=NC=C(C=C12)C3=C(C)ON=C3C)C4=CC=C(C=C4)C(O)=O)C5=NC=CC=C5
InChI
InChIKey=AMSUHYUVOVCWTP-INIZCTEOSA-N
InChI=1S/C26H22N4O3/c1-15-24(17(3)33-29-15)20-12-23-25(28-13-20)21(18-7-9-19(10-8-18)26(31)32)14-30(23)16(2)22-6-4-5-11-27-22/h4-14,16H,1-3H3,(H,31,32)/t16-/m0/s1
| Molecular Formula | C26H22N4O3 |
| Molecular Weight | 438.4779 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
AUC
| Value | Dose | Co-administered | Analyte | Population |
|---|---|---|---|---|
17700 ng × h/mL EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/29386193/ |
2 mg/kg single, oral dose: 2 mg/kg route of administration: Oral experiment type: SINGLE co-administered: |
PLX-51107 plasma | Mus musculus population: UNHEALTHY age: UNKNOWN sex: UNKNOWN food status: UNKNOWN |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 16:21:59 GMT 2025
by
admin
on
Tue Apr 01 16:21:59 GMT 2025
|
| Record UNII |
W758F1L9ND
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Name | Type | Language | ||
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Code | English | ||
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Preferred Name | English | ||
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Common Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C128462
Created by
admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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90448953
Created by
admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
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PRIMARY | |||
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W758F1L9ND
Created by
admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
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PRIMARY | |||
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1627929-55-8
Created by
admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
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PRIMARY | |||
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C125739
Created by
admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
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PRIMARY | NCIT |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
TARGET -> INHIBITOR |
BET bromodomains binding to tetra-acetylated histone H4 peptide (histone tails) using Amplified Luminescence Proximity Homogeneous Assay
IC50
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TARGET -> INHIBITOR |
BET bromodomains binding to tetra-acetylated histone H4 peptide (histone tails) using Amplified Luminescence Proximity Homogeneous Assay
IC50
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
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ACTIVE MOIETY |
