In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 6th, 2008 | 38 | 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) | 6.25 | 12.57 | -11.72 | 1 | 7 | 0 | 85 | 521.654 | 14 | ↓ |
Mid Mid (pH 6-8) | 5.66 | 13.22 | -17.51 | 0 | 7 | 0 | 82 | 521.654 | 14 | ↓ |