In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 18 | 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) | 2.70 | 6.7 | -38.67 | 3 | 3 | 1 | 46 | 249.378 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.70 | 5.46 | -7.69 | 2 | 3 | 0 | 41 | 248.37 | 8 | ↓ |