| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 23 | No |
Popular Name: 3-ethyl-7-[(2S)-2-methylpiperidine-1-carbonyl]-2-sulfanyl-quinazolin-4-one 3-ethyl-7-[(2S)-2-methylpiperidi…
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) | 2.05 | 7.41 | -40.91 | 0 | 5 | -1 | 61 | 330.433 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.60 | 8.69 | -11.37 | 1 | 5 | 0 | 58 | 331.441 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
