In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 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) | 0.94 | 1.54 | -16.06 | 2 | 5 | 0 | 75 | 226.619 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.39 | -1.09 | -59.72 | 1 | 5 | -1 | 78 | 225.611 | 2 | ↓ |