| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2007 | 28 | Yes |
| 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) | 3.37 | 4.93 | -42.03 | 0 | 5 | -1 | 73 | 395.797 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.18 | 7.98 | -16.14 | 1 | 5 | 0 | 66 | 396.805 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.18 | 7.47 | -11.11 | 1 | 5 | 0 | 66 | 396.805 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
