In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2009 | 32 | 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) | 4.78 | 12.17 | -13.84 | 1 | 4 | 0 | 28 | 489.966 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.78 | 14.43 | -47.74 | 2 | 4 | 1 | 29 | 490.974 | 10 | ↓ |