In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 18 | 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) | 1.20 | 4.92 | -9.39 | 1 | 4 | 0 | 59 | 241.225 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.20 | 5.37 | -47.45 | 2 | 4 | 1 | 60 | 242.233 | 1 | ↓ |