In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 9 | 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) | -0.12 | -1.77 | -9 | 3 | 3 | 0 | 55 | 126.159 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.12 | -0.5 | -39.01 | 4 | 3 | 1 | 60 | 127.167 | 3 | ↓ |