| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 25 | Yes |
Popular Name: (5S)-2-diethylamino-3-(3,4-dimethoxyphenyl)-5-isobutyl-5H-imidazol-4-one (5S)-2-diethylamino-3-(3,4-dimet…
| 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) | 3.20 | 9.82 | -8.87 | 0 | 6 | 0 | 54 | 347.459 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 11.6 | -18.57 | 1 | 6 | 0 | 64 | 347.459 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.22 | 9.51 | -39.29 | 2 | 6 | 1 | 66 | 348.467 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
