In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 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) | 2.52 | 7.83 | -40.52 | 1 | 3 | 1 | 31 | 230.335 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 5.47 | -6.41 | 0 | 3 | 0 | 30 | 229.327 | 3 | ↓ |