In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 14th, 2009 | 37 | 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) | 5.30 | 16.88 | -48.3 | 1 | 5 | 1 | 47 | 517.612 | 15 | ↓ |
Hi High (pH 8-9.5) | 5.30 | 14.83 | -13.15 | 0 | 5 | 0 | 46 | 516.604 | 15 | ↓ |