In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 16 | 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) | 2.09 | 5.55 | -7.43 | 0 | 3 | 0 | 24 | 246.782 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.09 | 7.87 | -44.41 | 1 | 3 | 1 | 25 | 247.79 | 6 | ↓ |