In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 33 | 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) | -1.56 | 4.56 | -98.95 | 10 | 11 | 2 | 189 | 461.567 | 12 | ↓ |
Mid Mid (pH 6-8) | -1.56 | 4.16 | -64.22 | 9 | 11 | 1 | 188 | 460.559 | 12 | ↓ |