| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 27 | No |
Popular Name: 3-ethyl-7-[(2R)-2-phenylpyrrolidine-1-carbonyl]-2-sulfanyl-quinazolin-4-one 3-ethyl-7-[(2R)-2-phenylpyrrolid…
| 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) | 2.80 | 10.05 | -37.68 | 0 | 5 | -1 | 61 | 378.477 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.34 | 11.33 | -14.23 | 1 | 5 | 0 | 58 | 379.485 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
