In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 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) | 5.69 | 14.8 | -128.45 | 0 | 5 | -2 | 97 | 482.661 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.69 | 12.89 | -66.11 | 1 | 5 | -1 | 94 | 483.669 | 5 | ↓ |