In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2009 | 14 | 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) | 1.85 | 7.23 | -45.03 | 0 | 4 | -1 | 66 | 201.242 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.85 | 5.25 | -7.67 | 1 | 4 | 0 | 64 | 202.25 | 7 | ↓ |