In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2010 | 22 | 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) | 4.12 | 10.5 | -39.14 | 2 | 2 | 1 | 16 | 360.319 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.12 | 9.46 | -45.39 | 2 | 2 | 1 | 20 | 360.319 | 5 | ↓ |