In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2008 | 27 | 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) | 0.15 | 7 | -46.41 | 3 | 7 | 0 | 114 | 366.373 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.15 | 5.33 | -52.48 | 2 | 7 | -1 | 110 | 365.365 | 3 | ↓ |