In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 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) | 3.37 | 8.34 | -7.15 | 1 | 3 | 0 | 38 | 227.311 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.37 | 8.81 | -26.88 | 2 | 3 | 1 | 39 | 228.319 | 2 | ↓ |