In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2004 | 34 | 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) | 3.39 | 6.99 | -15.98 | 3 | 9 | 0 | 133 | 480.908 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.39 | 7.31 | -65.97 | 4 | 9 | 1 | 134 | 481.916 | 8 | ↓ |