In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 16 | Yes |
Popular Name: 2-[1-[(2-fluorophenyl)methyl]imidazol-4-yl]ethanamine 2-[1-[(2-fluorophenyl)methyl]imi…
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) | 0.93 | 6.5 | -42.39 | 3 | 3 | 1 | 45 | 220.271 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.93 | 6.96 | -97.89 | 4 | 3 | 2 | 47 | 221.279 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.