In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 15 | 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) | -0.91 | -0.34 | -44.86 | 3 | 4 | 1 | 53 | 208.285 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.91 | 0.1 | -89.94 | 4 | 4 | 2 | 54 | 209.293 | 3 | ↓ |