In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2005 | 29 | 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) | 6.42 | 12.93 | -13.69 | 1 | 4 | 0 | 39 | 405.929 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.42 | 13.37 | -27.32 | 2 | 4 | 1 | 40 | 406.937 | 6 | ↓ |