In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 18th, 2008 | 22 | 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) | 0.45 | 2.65 | -63.69 | 3 | 9 | -1 | 151 | 338.35 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.90 | 0.18 | -128.31 | 2 | 9 | -2 | 154 | 337.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.