In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2007 | 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) | 4.57 | 10.6 | -47.96 | 2 | 8 | 1 | 90 | 509.623 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.54 | 11.25 | -49.58 | 1 | 8 | 1 | 87 | 509.623 | 12 | ↓ |