In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2005 | 40 | 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) | 5.80 | 5.63 | -46.56 | 0 | 11 | -1 | 132 | 545.62 | 14 | ↓ |
Mid Mid (pH 6-8) | 5.80 | 5.77 | -53.66 | 1 | 11 | 0 | 133 | 546.628 | 14 | ↓ |