| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 21 | No |
Popular Name: (3S)-3-methyl-1-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]piperidine-3-carboxylic (3S)-3-methyl-1-[2-(2-methyl-5-n…
| 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) | 0.46 | 10.18 | -59.22 | 1 | 8 | 0 | 108 | 296.327 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.46 | 8.33 | -50.04 | 0 | 8 | -1 | 107 | 295.319 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
