| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 21 | No |
Popular Name: (1S,8aR)-N-[(4-bromo-3-nitro-phenyl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-[(4-bromo-3-nitro-phe…
| 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) | 3.24 | 8.64 | -42.66 | 2 | 5 | 1 | 62 | 355.256 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 7.54 | -58.92 | 2 | 5 | 1 | 66 | 355.256 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 9.8 | -134.75 | 3 | 5 | 2 | 67 | 356.264 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
