| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 20 | Yes |
Popular Name: 2-[[[(2S)-1,4-dioxan-2-yl]methylamino]methyl]-3H-quinazolin-4-one 2-[[[(2S)-1,4-dioxan-2-yl]methyl…
| 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) | 0.28 | 1.4 | -22.15 | 2 | 6 | 0 | 76 | 275.308 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 3.24 | -54.18 | 3 | 6 | 1 | 81 | 276.316 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 0.68 | -49.43 | 2 | 6 | 0 | 84 | 275.308 | 4 | ↓ |
