In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 18 | 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) | 0.96 | 7.34 | -49.76 | 0 | 7 | -1 | 102 | 250.234 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.96 | 5.34 | -13.23 | 1 | 7 | 0 | 99 | 251.242 | 4 | ↓ |