In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2010 | 34 | 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) | 5.73 | 12.5 | -101.5 | 3 | 5 | 2 | 65 | 480.052 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.73 | 10.45 | -33.48 | 2 | 5 | 1 | 63 | 479.044 | 4 | ↓ |