In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 25th, 2008 | 31 | 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) | 3.86 | 8.76 | -105.32 | 0 | 8 | -2 | 128 | 434.791 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.40 | 11.21 | -55.45 | 1 | 8 | -1 | 125 | 435.799 | 4 | ↓ |