In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 11th, 2009 | 34 | 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) | 2.29 | 8.47 | -39.15 | 4 | 8 | 1 | 118 | 482.638 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 6.52 | -6.17 | 3 | 8 | 0 | 117 | 481.63 | 7 | ↓ |