In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2009 | 37 | 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) | 6.64 | 9.3 | -45.79 | 2 | 3 | -1 | 64 | 537.605 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.64 | 8.75 | -11.53 | 3 | 3 | 0 | 61 | 538.613 | 8 | ↓ |