| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2009 | 23 | Yes |
Popular Name: N-[(3R,4R)-3-hydroxy-2,2-dimethyl-6-propoxy-chroman-4-yl]-N-methyl-methanesulfonamide N-[(3R,4R)-3-hydroxy-2,2-dimethy…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.25 | 2.95 | -11.58 | 1 | 6 | 0 | 76 | 343.445 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| KCNE1-1-E | Voltage-gated Potassium Channel Beta Subunit Mink (cluster #1 Of 2), Eukaryotic | Eukaryotes | 900 | 0.37 | Binding ≤ 10μM |
| KCNQ1-1-E | Voltage-gated Potassium Channel Subunit Kv7.1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 900 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| KCNE1_HUMAN | P15382 | Voltage-gated Potassium Channel Beta Subunit Mink, Human | 900 | 0.37 | Binding ≤ 1μM |
| KCNQ1_HUMAN | P51787 | Voltage-gated Potassium Channel Subunit Kv7.1, Human | 900 | 0.37 | Binding ≤ 1μM |
| KCNE1_HUMAN | P15382 | Voltage-gated Potassium Channel Beta Subunit Mink, Human | 900 | 0.37 | Binding ≤ 10μM |
| KCNQ1_HUMAN | P51787 | Voltage-gated Potassium Channel Subunit Kv7.1, Human | 900 | 0.37 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Voltage gated Potassium channels |
