In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2010 | 35 | No |
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) | 1.98 | 4.61 | -74.38 | 3 | 9 | -1 | 142 | 481.525 | 12 | ↓ |
Lo Low (pH 4.5-6) | 1.98 | 3.86 | -27.98 | 4 | 9 | 0 | 139 | 482.533 | 12 | ↓ |