In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 30 | 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) | 1.15 | 2.27 | -49.85 | 2 | 9 | -1 | 137 | 428.808 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.69 | 4.71 | -20.56 | 3 | 9 | 0 | 134 | 429.816 | 6 | ↓ |