In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 6th, 2008 | 42 | 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) | 3.70 | 11.91 | -50.72 | 1 | 13 | -1 | 162 | 575.602 | 12 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 12.29 | -60.59 | 2 | 13 | 0 | 163 | 576.61 | 12 | ↓ |