In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 21 | 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) | -1.83 | 8.23 | -122.64 | 0 | 9 | -2 | 146 | 292.203 | 5 | ↓ |
Lo Low (pH 4.5-6) | -1.83 | 6.09 | -54.15 | 1 | 9 | -1 | 144 | 293.211 | 5 | ↓ |