In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2007 | 35 | 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) | 3.13 | 9.79 | -57.74 | 2 | 8 | 1 | 90 | 481.569 | 11 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 10.43 | -69.2 | 1 | 8 | 1 | 87 | 481.569 | 11 | ↓ |