| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 27 | Yes |
Popular Name: 6,8-dibromo-2-[[[(1S)-1-(2-naphthyl)ethyl]amino]methyl]-3H-quinazolin-4-one 6,8-dibromo-2-[[[(1S)-1-(2-napht…
| 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) | 5.31 | 10.06 | -9.6 | 2 | 4 | 0 | 58 | 487.195 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.31 | 11.15 | -56.69 | 3 | 4 | 1 | 62 | 488.203 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.77 | 7.51 | -40.2 | 1 | 4 | -1 | 61 | 486.187 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.77 | 8.6 | -42.01 | 2 | 4 | 0 | 65 | 487.195 | 4 | ↓ |
