Compound Detail
CHEMBL492472
SCUTELLARIC ACID Enter ChEMBL ID:
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CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2C1
Basic Information
| ChEMBL ID | CHEMBL492472 |
| Name | SCUTELLARIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PGOYMURMZNDHNS-JZLUYQONSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
10
Publications
0
Known Names
Molecular Properties
472.7
MW (Da)
6.21
ALogP
3
HBA
3
HBD
77.8
PSA (Ų)
0.42
QED
1
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 18798681 | 10.1021/np800298w | Tyrosine-protein phosphatase non-receptor type 1 | 1 |
| 19555121 | 10.1021/np900068t | Vero | 1 |
| 19555121 | 10.1021/np900068t | ADMET | 1 |
| 19555121 | 10.1021/np900068t | HepG2 | 1 |
| 19555121 | 10.1021/np900068t | SK-MEL | 1 |
| 19555121 | 10.1021/np900068t | KB | 1 |
| 19555121 | 10.1021/np900068t | BT-549 | 1 |
| 19555121 | 10.1021/np900068t | SK-OV-3 | 1 |
| 19555121 | 10.1021/np900068t | SW1353 | 1 |
| 19555121 | 10.1021/np900068t | Transcription factor Sp1 | 1 |
Data from ChEMBL 36 via Core Engine