In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 37 | 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) | 4.70 | 13.22 | -13.11 | 0 | 7 | 0 | 82 | 498.579 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.70 | 13.69 | -42.44 | 1 | 7 | 1 | 83 | 499.587 | 8 | ↓ |