In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 39 | 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) | 4.15 | 10.83 | -17.15 | 0 | 8 | 0 | 75 | 531.653 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 13.14 | -46.35 | 1 | 8 | 1 | 77 | 532.661 | 9 | ↓ |