In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2007 | 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) | 3.73 | 10.82 | -72.37 | 1 | 6 | 0 | 74 | 440.515 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.15 | 1.24 | -43.03 | 1 | 6 | 1 | 68 | 441.523 | 10 | ↓ |