| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 20 | No |
Popular Name: 3-[(1S,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]-2-sulfanyl-quinazolin-4-one 3-[(1S,8R)-2,3,5,6,7,8-hexahydro…
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) | 2.04 | 7.28 | -38.79 | 1 | 4 | 0 | 45 | 287.388 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 8.4 | -33.87 | 2 | 4 | 1 | 42 | 288.396 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
