In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 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) | 3.31 | 12.17 | -75.11 | 1 | 9 | 0 | 120 | 465.506 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.31 | 11.36 | -59.38 | 2 | 9 | 1 | 117 | 466.514 | 11 | ↓ |