In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2010 | 34 | 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) | 2.13 | 5.59 | -33.6 | 5 | 13 | 1 | 171 | 470.514 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 3.41 | -11.53 | 4 | 13 | 0 | 170 | 469.506 | 8 | ↓ |