In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 18 | 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) | 0.80 | -0.42 | -60 | 5 | 5 | 1 | 93 | 244.274 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.80 | -0.81 | -14.39 | 4 | 5 | 0 | 91 | 243.266 | 4 | ↓ |