In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 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) | 3.41 | 11.45 | -19.74 | 1 | 11 | 0 | 137 | 498.546 | 10 | ↓ |
Hi High (pH 8-9.5) | 3.59 | 10.23 | -39.45 | 0 | 11 | -1 | 143 | 497.538 | 10 | ↓ |