In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 16th, 2010 | 35 | 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) | 7.31 | 12.91 | -8.46 | 2 | 5 | 0 | 69 | 506.433 | 5 | ↓ |
Mid Mid (pH 6-8) | 7.31 | 13.69 | -46.73 | 1 | 5 | -1 | 72 | 505.425 | 5 | ↓ |