| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 25 | No |
Popular Name: (5Z)-5-[(6-methoxy-1H-indol-3-yl)methylene]-2-(2-pyridylamino)thiazol-4-one (5Z)-5-[(6-methoxy-1H-indol-3-yl…
| 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) | 3.44 | 6.84 | -21.68 | 2 | 6 | 0 | 80 | 350.403 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 6.42 | -47.99 | 1 | 6 | -1 | 81 | 349.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.44 | 6.4 | -48.14 | 1 | 6 | -1 | 82 | 349.395 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 7.52 | -38.77 | 3 | 6 | 1 | 81 | 351.411 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.17 | 7.11 | -20.45 | 2 | 6 | 0 | 83 | 350.403 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
