In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2009 | 17 | 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) | 3.41 | 5.29 | -5.08 | 1 | 2 | 0 | 23 | 247.26 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.41 | 6.51 | -37.22 | 2 | 2 | 1 | 25 | 248.268 | 5 | ↓ |