In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2011 | 18 | 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) | -0.06 | 7.02 | -104.99 | 1 | 6 | -2 | 109 | 257.286 | 10 | ↓ |
Lo Low (pH 4.5-6) | -0.06 | 5.04 | -55.56 | 2 | 6 | -1 | 107 | 258.294 | 10 | ↓ |