In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 5th, 2007 | 37 | No |
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) | 4.33 | 12.47 | -56.42 | 0 | 9 | -1 | 125 | 501.515 | 10 | ↓ |
Lo Low (pH 4.5-6) | 4.33 | 11.51 | -17.07 | 1 | 9 | 0 | 122 | 502.523 | 10 | ↓ |