In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 32 | Yes |
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) | 1.63 | 7.57 | -95.94 | 2 | 10 | -2 | 157 | 442.424 | 11 | ↓ |
Lo Low (pH 4.5-6) | 1.63 | 5.59 | -54.01 | 3 | 10 | -1 | 154 | 443.432 | 11 | ↓ |