In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 5th, 2009 | 17 | 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) | 3.32 | 6.84 | -2.87 | 1 | 1 | 0 | 12 | 223.319 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.32 | 8.29 | -45.69 | 2 | 1 | 1 | 17 | 224.327 | 1 | ↓ |