In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 17 | 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) | 1.32 | 1.76 | -10 | 2 | 6 | 0 | 80 | 232.243 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 1.63 | -39.89 | 1 | 6 | -1 | 78 | 231.235 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.