| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 22 | Yes |
Popular Name: (2S)-N-[2-[(1R)-2-cyano-1-methyl-ethyl]sulfanylphenyl]-2-imidazol-1-yl-propanamide (2S)-N-[2-[(1R)-2-cyano-1-methyl…
| 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) | 1.37 | 10.14 | -40.54 | 2 | 5 | 1 | 72 | 315.422 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.37 | 9.31 | -19.51 | 1 | 5 | 0 | 71 | 314.414 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
