In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | 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) | 3.58 | 7.8 | -118.82 | 4 | 2 | 2 | 32 | 230.44 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 6.43 | -42.72 | 3 | 2 | 1 | 31 | 229.432 | 10 | ↓ |