In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2010 | 31 | 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) | 0.66 | 10.12 | -110.86 | 3 | 7 | 0 | 102 | 433.455 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.09 | 8.16 | -89 | 4 | 7 | 1 | 105 | 434.463 | 4 | ↓ |