The store will not work correctly when cookies are disabled.
O,O-dibutyl Se-phenyl phosphoroselenoate
ID: ALA4763542
Chembl Id: CHEMBL4763542
PubChem CID: 15457739
Max Phase: Preclinical
Molecular Formula: C14H23O3PSe
Molecular Weight: 349.27
Molecule Type: Unknown
Associated Items:
Names and Identifiers
Canonical SMILES: CCCCOP(=O)(OCCCC)[Se]c1ccccc1
Standard InChI: InChI=1S/C14H23O3PSe/c1-3-5-12-16-18(15,17-13-6-4-2)19-14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3
Standard InChI Key: MXTQQJDYTJEKQT-UHFFFAOYSA-N
Associated Targets(non-human)
Molecule Features
Natural Product: No | Oral: No | Chemical Probe: No | Parenteral: No |
Molecule Type: Unknown | Topical: No | First In Class: No | Black Box: No |
Chirality: No | Availability: No | Prodrug: No |
Drug Indications
MESH ID | MESH Heading | EFO IDs | EFO Terms | Max Phase for Indication | References |
---|
Mechanisms of Action
Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
---|
Calculated Properties
Molecular Weight: 349.27 | Molecular Weight (Monoisotopic): 350.0550 | AlogP: ┄ | #Rotatable Bonds: ┄ |
Polar Surface Area: ┄ | Molecular Species: ┄ | HBA: ┄ | HBD: ┄ |
#RO5 Violations: ┄ | HBA (Lipinski): ┄ | HBD (Lipinski): ┄ | #RO5 Violations (Lipinski): ┄ |
CX Acidic pKa: ┄ | CX Basic pKa: ┄ | CX LogP: ┄ | CX LogD: ┄ |
Aromatic Rings: ┄ | Heavy Atoms: ┄ | QED Weighted: ┄ | Np Likeness Score: ┄ |
References
1. Mailahn DH,Iarocz LEB,Nobre PC,Perin G,Sinott A,Pesarico AP,Birmann PT,Savegnago L,Silva MS. (2021) A greener protocol for the synthesis of phosphorochalcogenoates: Antioxidant and free radical scavenging activities., 213 [PMID:33272781] [10.1016/j.ejmech.2020.113052] |