| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 21 | No |
Popular Name: 3-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-2-sulfanyl-quinazolin-4-one 3-[(1S,8aR)-1,2,3,5,6,7,8,8a-oct…
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) | 2.54 | 8.31 | -37.97 | 1 | 4 | 0 | 45 | 301.415 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 9.42 | -33.26 | 2 | 4 | 1 | 42 | 302.423 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
