| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2014 | 30 | 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) | 3.91 | 15.41 | -52.03 | 1 | 5 | 0 | 71 | 405.494 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.91 | 13.93 | -66.52 | 0 | 5 | -1 | 70 | 404.486 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.