In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 31 | 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) | 3.95 | 8.47 | -46.91 | 1 | 9 | -1 | 136 | 457.513 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.95 | 8.39 | -25.98 | 2 | 9 | 0 | 134 | 458.521 | 6 | ↓ |