In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 12th, 2011 | 13 | Yes |
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) | 0.99 | 7.1 | -131.98 | 0 | 4 | -2 | 80 | 182.175 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.99 | 5.11 | -55.66 | 1 | 4 | -1 | 77 | 183.183 | 5 | ↓ |