In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 17th, 2006 | 25 | No |
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) | -1.86 | 8.23 | -28.94 | 3 | 7 | 1 | 93 | 338.391 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.14 | 5.83 | -12.25 | 0 | 5 | 0 | 48 | 339.819 | 4 | ↓ |