In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 17 | 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) | 2.64 | 6.39 | -5.43 | 0 | 2 | 0 | 27 | 226.323 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.64 | 8.83 | -50.54 | 1 | 2 | 1 | 28 | 227.331 | 2 | ↓ |