In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 4th, 2009 | 36 | 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) | 5.80 | 14.74 | -56.37 | 2 | 6 | 1 | 72 | 481.62 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.80 | 12.45 | -15.85 | 1 | 6 | 0 | 71 | 480.612 | 7 | ↓ |