In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2009 | 29 | 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) | -1.65 | -3.07 | -95 | 6 | 10 | 0 | 169 | 426.495 | 8 | ↓ |
Hi High (pH 8-9.5) | -1.65 | -4.37 | -95.09 | 5 | 10 | -1 | 165 | 425.487 | 8 | ↓ |