In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2009 | 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) | -4.20 | -0.72 | -97.53 | 9 | 8 | 1 | 163 | 232.264 | 7 | ↓ |
Hi High (pH 8-9.5) | -4.20 | -2.02 | -76.4 | 8 | 8 | 0 | 161 | 231.256 | 7 | ↓ |