In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 36 | 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) | 2.48 | 7.69 | -90.88 | 2 | 10 | 0 | 122 | 500.548 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.48 | 8.71 | -156.44 | 1 | 10 | -1 | 125 | 499.54 | 11 | ↓ |