Compound Detail
CHEMBL9314
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O=c1ccn([C@H]2[C@H](O)[C@H](O)[C@@]3(COP(=O)(O)OP(=O)(O)O)C[C@H]23)c(=O)[nH]1
Basic Information
| ChEMBL ID | CHEMBL9314 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | BFWUJFNKDUGYMX-OHVCGCLXSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
414.2
MW (Da)
-1.95
ALogP
9
HBA
6
HBD
208.6
PSA (Ų)
0.28
QED
1
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16366591 | 10.1021/jm050911p | P2Y purinoceptor 6 | 1 |
| 19902968 | 10.1021/jm901432g | P2Y purinoceptor 14 | 1 |
| 19902968 | 10.1021/jm901432g | P2Y purinoceptor 6 | 1 |
| 20446735 | 10.1021/jm100287t | P2Y purinoceptor 6 | 1 |
Data from ChEMBL 36 via Core Engine