In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 20 | 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) | 2.39 | 7.53 | -42.37 | 3 | 5 | 1 | 60 | 278.376 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 5.33 | -4.85 | 2 | 5 | 0 | 59 | 277.368 | 5 | ↓ |