The store will not work correctly when cookies are disabled.
1-((3,4,5-trimethoxyphenyl)tellanyl)propan-2-amine
ID: ALA5272463
Chembl Id: CHEMBL5272463
Max Phase: Preclinical
Molecular Formula: C12H19NO3Te
Molecular Weight: 352.89
Associated Items:
Names and Identifiers
Canonical SMILES: COc1cc([Te]CC(C)N)cc(OC)c1OC
Standard InChI: InChI=1S/C12H19NO3Te/c1-8(13)7-17-9-5-10(14-2)12(16-4)11(6-9)15-3/h5-6,8H,7,13H2,1-4H3
Standard InChI Key: AKHNXNYNHUXRHB-UHFFFAOYSA-N
Associated Targets(Human)
Molecule Features
Natural Product: No | Oral: No | Chemical Probe: No | Parenteral: No |
Molecule Type: | 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: 352.89 | Molecular Weight (Monoisotopic): 355.0427 | 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. Provensi G, Costa A, Rani B, Becagli MV, Vaiano F, Passani MB, Tanini D, Capperucci A, Carradori S, Petzer JP, Petzer A, Vullo D, Costantino G, Blandina P, Angeli A, Supuran CT.. (2022) New β-arylchalcogeno amines with procognitive properties targeting Carbonic Anhydrases and Monoamine Oxidases., 244 [PMID:36244185] [10.1016/j.ejmech.2022.114828] |