In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 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) | -1.56 | -1.42 | -128.79 | 2 | 6 | -2 | 121 | 190.151 | 6 | ↓ |
Lo Low (pH 4.5-6) | -1.56 | -2.55 | -57 | 3 | 6 | -1 | 118 | 191.159 | 6 | ↓ |
Lo Low (pH 4.5-6) | -1.56 | -2.54 | -60.96 | 3 | 6 | -1 | 118 | 191.159 | 6 | ↓ |