In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
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) | 1.87 | 7.33 | -120.63 | 4 | 2 | 2 | 32 | 252.427 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 5.77 | -44.94 | 3 | 2 | 1 | 31 | 251.419 | 4 | ↓ |