| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
ID: ALA4588020
Max Phase: Preclinical
Molecular Formula: C17H17NO2
Molecular Weight: 267.33
Molecule Type: Unknown
Associated Items:
Representations
Canonical SMILES: Cc1ccc2c(c1)c1cc(C)ccc1n2CCC(=O)O
Standard InChI: InChI=1S/C17H17NO2/c1-11-3-5-15-13(9-11)14-10-12(2)4-6-16(14)18(15)8-7-17(19)20/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)
Standard InChI Key: HGNUMQLEWYESCT-UHFFFAOYSA-N
Associated Targets(Human)
Potassium channel subfamily K member 2 490 Activities
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 |
|---|
Properties
| Molecular Weight: 267.33 | Molecular Weight (Monoisotopic): 267.1259 | AlogP: 3.89 | #Rotatable Bonds: 3 |
| Polar Surface Area: 42.23 | Molecular Species: ACID | HBA: 2 | HBD: 1 |
| #RO5 Violations: 0 | HBA (Lipinski): 3 | HBD (Lipinski): 1 | #RO5 Violations (Lipinski): 0 |
| CX Acidic pKa: 4.97 | CX Basic pKa: | CX LogP: 4.06 | CX LogD: 1.66 |
| Aromatic Rings: 3 | Heavy Atoms: 20 | QED Weighted: 0.78 | Np Likeness Score: -0.60 |
References
| 1. (2016) Modulation of k2p channels, |
Source
Source(1):