| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | No |
Popular Name: (E)-4-[cyclopropyl-[(1-methylimidazol-2-yl)methyl]amino]-4-oxo-but-2-enoic (E)-4-[cyclopropyl-[(1-methylimi…
| 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) | -0.64 | 7.38 | -54.04 | 1 | 6 | 0 | 80 | 249.27 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.64 | 6.5 | -42.75 | 0 | 6 | -1 | 78 | 248.262 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
