In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 34 | Yes |
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) | 3.23 | 9.34 | -60.71 | 2 | 7 | 1 | 60 | 462.618 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.23 | 7.03 | -17.39 | 1 | 7 | 0 | 59 | 461.61 | 6 | ↓ |