| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 24 | Yes |
Popular Name: 2-[2-[(3S)-4-(2-methoxyethyl)-3-methyl-piperazin-1-yl]ethyl]-3H-quinazolin-4-one 2-[2-[(3S)-4-(2-methoxyethyl)-3-…
| 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) | 1.50 | 5.44 | -50.11 | 2 | 6 | 1 | 63 | 331.44 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.50 | 3.2 | -10.51 | 1 | 6 | 0 | 61 | 330.432 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 3.05 | -52.19 | 1 | 6 | 0 | 66 | 330.432 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.50 | 5.44 | -40.76 | 2 | 6 | 1 | 63 | 331.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
