In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 20th, 2008 | 19 | Yes |
Popular Name: 6-chloro-1,1-dioxo-N-[(1R)-1,2,2-trimethylpropyl]-4H-thieno[3,2-e][1,2,4]thiadiazin-3-amine 6-chloro-1,1-dioxo-N-[(1R)-1,2,2…
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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) | 3.35 | 5.3 | -15.7 | 2 | 5 | 0 | 71 | 321.855 | 3 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50597-1-O | Rattus Norvegicus (cluster #1 Of 12), Other | Other | 2000 | 0.42 | Functional ≤ 10μM |
Z80700-1-O | Beta-TC6 (Pancreatic Insulinoma Cells) (cluster #1 Of 1), Other | Other | 750 | 0.45 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80700 | Z80700 | Beta-TC6 (Pancreatic Insulinoma Cells) | 750 | 0.45 | Functional ≤ 10μM |
Z50597 | Z50597 | Rattus Norvegicus | 2000 | 0.42 | Functional ≤ 10μM |