In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2010 | 25 | 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) | -1.81 | -3.77 | -157.63 | 4 | 13 | -2 | 201 | 375.234 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.81 | -4.93 | -65.89 | 5 | 13 | -1 | 198 | 376.242 | 4 | ↓ |