In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 28 | 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) | 3.81 | -1.02 | -7.55 | 3 | 5 | 0 | 82 | 385.504 | 0 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 0.72 | -35.57 | 4 | 5 | 1 | 84 | 386.512 | 0 | ↓ |