| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 27th, 2010 | 22 | No |
Popular Name: (2R)-1-[(2S)-2-(1-methylbenzimidazol-2-yl)-1-piperidyl]-2-methylsulfanyl-propan-1-one (2R)-1-[(2S)-2-(1-methylbenzimid…
| 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) | 2.71 | 9.03 | -18.61 | 0 | 4 | 0 | 38 | 317.458 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.71 | 9.37 | -26.01 | 1 | 4 | 1 | 39 | 318.466 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
