In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2006 | 26 | 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) | 5.21 | 10.37 | -37.77 | 2 | 4 | 1 | 39 | 372.92 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.21 | 10.81 | -81.06 | 3 | 4 | 2 | 40 | 373.928 | 7 | ↓ |