In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 8th, 2010 | 21 | 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) | -5.05 | -6.71 | -89.17 | 8 | 10 | 0 | 189 | 304.303 | 9 | ↓ |
Hi High (pH 8-9.5) | -5.05 | -7 | -59.09 | 7 | 10 | -1 | 188 | 303.295 | 9 | ↓ |