In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2010 | 19 | No |
Popular Name: 2-[[2-[(1R)-1-chloroethyl]-5-fluoro-benzimidazol-1-yl]methyl]thiazole 2-[[2-[(1R)-1-chloroethyl]-5-flu…
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) | 2.94 | 7.81 | -10.69 | 0 | 3 | 0 | 31 | 295.77 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.94 | 8.32 | -29.38 | 1 | 3 | 1 | 32 | 296.778 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.