In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 15 | Yes |
None
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) | 2.07 | 3.19 | -37.05 | 4 | 3 | 1 | 60 | 248.133 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.07 | 2.15 | -5.94 | 3 | 3 | 0 | 55 | 247.125 | 4 | ↓ |