| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 28th, 2008 | 25 | Yes |
Popular Name: 7-chloro-2-[[4-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]methyl]-3H-quinazolin-4-one 7-chloro-2-[[4-[[(2S)-tetrahydro…
| 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) | 1.81 | 6.45 | -49.38 | 2 | 6 | 1 | 63 | 363.869 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.27 | 3.13 | -39.09 | 0 | 6 | -1 | 65 | 361.853 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.81 | 4.18 | -10.39 | 1 | 6 | 0 | 61 | 362.861 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.27 | 5.4 | -36.21 | 1 | 6 | 0 | 66 | 362.861 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.81 | 6.56 | -41.86 | 2 | 6 | 1 | 63 | 363.869 | 4 | ↓ |
