| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2011 | 29 | Yes |
| 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) | 1.76 | 5.75 | -52.16 | 4 | 7 | 1 | 94 | 430.476 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 3.55 | -20.11 | 3 | 7 | 0 | 93 | 429.468 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
