In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2008 | 27 | 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) | 5.19 | 11.25 | -36.36 | 1 | 5 | 0 | 58 | 404.967 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.19 | 10.54 | -38.81 | 2 | 5 | 1 | 55 | 405.975 | 4 | ↓ |