In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2008 | 13 | 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) | -0.18 | 2.24 | -42.87 | 2 | 4 | 1 | 46 | 187.263 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.18 | 0.85 | -7.82 | 1 | 4 | 0 | 42 | 186.255 | 4 | ↓ |