| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 8th, 2011 | 31 | 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) | 1.89 | 2.78 | -11.2 | 3 | 9 | 0 | 110 | 445.545 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.89 | 4.98 | -55.1 | 4 | 9 | 1 | 111 | 446.553 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
