In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 17 | 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) | 2.61 | 7.74 | -49.36 | 2 | 4 | -1 | 69 | 233.291 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | 7.22 | -63.81 | 3 | 4 | 0 | 71 | 234.299 | 5 | ↓ |