In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 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) | -0.67 | -0.54 | -9.76 | 1 | 4 | 0 | 44 | 186.255 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.67 | 1.85 | -48.05 | 2 | 4 | 1 | 45 | 187.263 | 2 | ↓ |