Compound Detail
CHEMBL3974000
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CCCC1([C@@H](O)c2cccc([C@H]3CCC(=O)[C@@H]3C/C=C\CCCC(=O)OC)c2)CCC1
Basic Information
| ChEMBL ID | CHEMBL3974000 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | JZCLXOPFWAABCG-QIDUYIHQSA-N |
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names
Molecular Properties
426.6
MW (Da)
6.04
ALogP
4
HBA
1
HBD
63.6
PSA (Ų)
0.27
QED
1
Ro5 Violations
11
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Data from ChEMBL 36 via Core Engine