In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 13th, 2006 | 26 | No |
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) | 7.60 | 10.03 | -36.67 | 0 | 3 | -1 | 53 | 602.878 | 1 | ↓ |
Mid Mid (pH 6-8) | 7.60 | 10.09 | -13.72 | 1 | 3 | 0 | 50 | 603.886 | 1 | ↓ |