| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | No |
| 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) | 2.19 | 7.69 | -10.52 | 1 | 4 | 0 | 47 | 310.444 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 6.48 | -39.12 | 0 | 4 | -1 | 50 | 309.436 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
