| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 44 | 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) | 4.05 | 18.61 | -50.7 | 1 | 11 | -1 | 150 | 594.648 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.51 | 16.16 | -113.28 | 0 | 11 | -2 | 153 | 593.64 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
