In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | 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) | -0.81 | 2.36 | -54.79 | 2 | 5 | 1 | 57 | 214.289 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.81 | 1.07 | -9.94 | 1 | 5 | 0 | 53 | 213.281 | 3 | ↓ |