In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2006 | 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) | 4.70 | 12.7 | -40.96 | 1 | 2 | 1 | 9 | 293.434 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.70 | 10.78 | -4.84 | 0 | 2 | 0 | 8 | 292.426 | 2 | ↓ |