In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2006 | 19 | 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) | -1.07 | -2.19 | -17.53 | 3 | 7 | 0 | 105 | 288.687 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.61 | -4.86 | -55.67 | 2 | 7 | -1 | 108 | 287.679 | 3 | ↓ |