In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2009 | 18 | Yes |
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) | 1.77 | 8.77 | -37.2 | 1 | 4 | 1 | 52 | 242.302 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 8.3 | -13.89 | 0 | 4 | 0 | 51 | 241.294 | 5 | ↓ |