In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 27 | 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) | -1.38 | -3.77 | -37.51 | 3 | 11 | -1 | 160 | 374.333 | 3 | ↓ |
Lo Low (pH 4.5-6) | -1.38 | -3.32 | -48.93 | 4 | 11 | 0 | 162 | 375.341 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.