In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 12 | 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) | 0.74 | 2 | -5.83 | 1 | 3 | 0 | 49 | 161.208 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.74 | 3.41 | -38.37 | 2 | 3 | 1 | 53 | 162.216 | 2 | ↓ |