In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2010 | 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) | 6.79 | 14.6 | -38.3 | 0 | 4 | -1 | 74 | 467.67 | 10 | ↓ |
Mid Mid (pH 6-8) | 6.05 | 16.68 | -13.32 | 0 | 4 | 0 | 68 | 468.678 | 10 | ↓ |