In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | 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) | 2.25 | 3.45 | -39.39 | 4 | 3 | 1 | 61 | 233.213 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.66 | 3.64 | -8.05 | 4 | 3 | 0 | 61 | 232.205 | 5 | ↓ |