In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 17th, 2008 | 21 | 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) | 0.55 | 4.44 | -16.32 | 2 | 5 | 0 | 71 | 283.331 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.55 | 4.71 | -48.77 | 3 | 5 | 1 | 72 | 284.339 | 5 | ↓ |