| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2011 | 22 | No |
Popular Name: 3-methyl-7-[(2S)-2-methylpiperidine-1-carbonyl]-2-sulfanyl-quinazolin-4-one 3-methyl-7-[(2S)-2-methylpiperid…
None
| 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) | 1.68 | 6.34 | -39.46 | 0 | 5 | -1 | 61 | 316.406 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.22 | 7.6 | -11.13 | 1 | 5 | 0 | 58 | 317.414 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
