In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 14 | 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) | 0.37 | 4.05 | -42.08 | 3 | 3 | 1 | 43 | 230.382 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.37 | 1.71 | -12.83 | 2 | 3 | 0 | 42 | 229.374 | 6 | ↓ |