In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 25th, 2009 | 33 | 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) | 1.51 | 7.27 | -26.56 | 2 | 11 | 0 | 133 | 489.583 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 6.2 | -51.7 | 1 | 11 | -1 | 139 | 488.575 | 9 | ↓ |