In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 16 | 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) | 1.21 | 5.9 | -40.11 | 1 | 3 | 1 | 25 | 225.356 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 8.07 | -111.54 | 2 | 3 | 2 | 26 | 226.364 | 3 | ↓ |