In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 38 | 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) | 5.26 | 14 | -13.01 | 0 | 7 | 0 | 82 | 512.606 | 9 | ↓ |
Lo Low (pH 4.5-6) | 5.26 | 14.46 | -42.79 | 1 | 7 | 1 | 83 | 513.614 | 9 | ↓ |