| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 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) | 3.00 | 7.89 | -19.78 | 2 | 7 | 0 | 88 | 419.481 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 6.2 | -56.55 | 1 | 7 | -1 | 94 | 418.473 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
