| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
ID: ALA3596577
Max Phase: Preclinical
Molecular Formula: Na2S3
Molecular Weight: 98.22
Molecule Type: Small molecule
Associated Items:
Representations
Canonical SMILES: [Na+].[Na+].[S-]S[S-]
Standard InChI: InChI=1S/2Na.H2S3/c;;1-3-2/h;;1-2H/q2*+1;/p-2
Standard InChI Key: OLPXIHXXKBDZES-UHFFFAOYSA-L
Associated Targets(non-human)
Transient receptor potential cation channel subfamily A member 1 1003 Activities
Molecule Features
| Natural Product: No | Oral: No | Chemical Probe: No | Parenteral: No |
| Molecule Type: Small molecule | 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 |
|---|
Properties
| Molecular Weight: 98.22 | Molecular Weight (Monoisotopic): 97.9319 | AlogP: 1.41 | #Rotatable Bonds: 0 |
| Polar Surface Area: 0.00 | Molecular Species: NEUTRAL | HBA: 3 | HBD: 2 |
| #RO5 Violations: 0 | HBA (Lipinski): 0 | HBD (Lipinski): 0 | #RO5 Violations (Lipinski): 0 |
| CX Acidic pKa: 8.92 | CX Basic pKa: | CX LogP: 1.64 | CX LogD: 1.63 |
| Aromatic Rings: 0 | Heavy Atoms: 3 | QED Weighted: 0.34 | Np Likeness Score: -0.63 |
References
| 1. Marutani E, Sakaguchi M, Chen W, Sasakura K, Liu J, Xian M, Hanaoka K, Nagano T, Ichinose F.. (2014) Cytoprotective effects of hydrogen sulfide-releasing N-methyl-D-aspartate receptor antagonists are mediated by intracellular sulfane sulfur., 5 (10): [PMID:25431645] [10.1039/c4md00180j] |
Source
Source(1):