| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 1st, 2008 | 31 | 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) | 2.07 | -0.86 | -24.05 | 2 | 9 | 0 | 110 | 436.553 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | -0.3 | -78.97 | 1 | 9 | -1 | 113 | 435.545 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.