In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2009 | 34 | 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) | 6.83 | 14.5 | -33.89 | 0 | 4 | -1 | 74 | 467.67 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.25 | 14.5 | -7.44 | 0 | 4 | 0 | 68 | 468.678 | 9 | ↓ |