In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 9th, 2007 | 35 | 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) | 4.58 | -2.15 | -16.33 | 1 | 6 | 0 | 72 | 479.609 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | -2.01 | -44.71 | 2 | 6 | 1 | 73 | 480.617 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | -2.09 | -47.2 | 2 | 6 | 1 | 73 | 480.617 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.58 | -1.96 | -81.34 | 3 | 6 | 2 | 75 | 481.625 | 8 | ↓ |