In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 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) | 0.42 | 1.77 | -5.39 | 0 | 3 | 0 | 25 | 178.235 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.42 | 2.16 | -32.42 | 1 | 3 | 1 | 27 | 179.243 | 2 | ↓ |