In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 11 | 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) | 2.54 | 6.63 | -29.54 | 1 | 1 | 1 | 4 | 154.277 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.54 | 4.93 | -1.81 | 0 | 1 | 0 | 3 | 153.269 | 3 | ↓ |