In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 16th, 2010 | 15 | 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) | 3.09 | 7.5 | -42.98 | 1 | 3 | -1 | 42 | 218.305 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 7.54 | -27.69 | 2 | 3 | 0 | 43 | 219.313 | 3 | ↓ |