| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 20 | Yes |
Popular Name: 7-chloro-2-[[[(1S)-2-ethoxy-1-methyl-ethyl]amino]methyl]-3H-quinazolin-4-one 7-chloro-2-[[[(1S)-2-ethoxy-1-me…
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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) | 1.99 | 3.92 | -8.8 | 2 | 5 | 0 | 67 | 295.77 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.45 | 1.35 | -42.07 | 1 | 5 | -1 | 70 | 294.762 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.99 | 5.15 | -48.57 | 3 | 5 | 1 | 72 | 296.778 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.45 | 2.59 | -39.78 | 2 | 5 | 0 | 75 | 295.77 | 6 | ↓ |
