In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 12 | 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) | -1.56 | -3.61 | -96.58 | 7 | 5 | 2 | 97 | 177.248 | 7 | ↓ |
Mid Mid (pH 6-8) | -4.39 | -3.63 | -29.83 | 7 | 5 | 1 | 97 | 176.24 | 7 | ↓ |