In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 15th, 2011 | 17 | 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) | 0.82 | 1.63 | -43.92 | 4 | 3 | 1 | 51 | 235.351 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.82 | 3.89 | -110.24 | 5 | 3 | 2 | 52 | 236.359 | 3 | ↓ |