In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2010 | 36 | 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) | 4.18 | 10.46 | -13.26 | 0 | 7 | 0 | 72 | 484.552 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.18 | 12.73 | -46.92 | 1 | 7 | 1 | 73 | 485.56 | 6 | ↓ |