In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 24 | 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) | -3.21 | 0.78 | -94.19 | 10 | 9 | 1 | 181 | 338.388 | 10 | ↓ |
Mid Mid (pH 6-8) | -3.21 | 0.43 | -69.75 | 9 | 9 | 0 | 179 | 337.38 | 10 | ↓ |