In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 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) | 0.91 | 4.29 | -55.61 | 1 | 12 | -1 | 173 | 518.524 | 11 | ↓ |
Lo Low (pH 4.5-6) | 0.91 | 3.54 | -20.82 | 2 | 12 | 0 | 170 | 519.532 | 11 | ↓ |