In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2009 | 32 | 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) | 3.43 | 8.54 | -59.01 | 0 | 7 | -1 | 88 | 477.32 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.43 | 7.72 | -18.55 | 1 | 7 | 0 | 85 | 478.328 | 7 | ↓ |