| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 231HZQ66PD |
Structure
| InChI Key | IAKCDZCRAWGHFD-YDZHTSKRSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H23Cl2N3O2 |
| Molecular Weight | 407.12 |
| AlogP | 3.53 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 48.3 |
| Heavy Atoms | 27.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 96164-19-1 |
| NORMAN SUSDAT | |
| FDA SRS | 231HZQ66PD |
CONTENTS
