In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 15th, 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) | 5.11 | 7.89 | -14.92 | 3 | 8 | 0 | 108 | 514.022 | 11 | ↓ |
Mid Mid (pH 6-8) | 5.11 | 8.65 | -53.05 | 2 | 8 | -1 | 111 | 513.014 | 11 | ↓ |