| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 21st, 2011 | 24 | Yes |
Popular Name: (2S)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanylmethyl]pentanedinitrile (2S)-2-[(1-phenyl-4,5,6,7-tetrah…
| 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) | 3.31 | 12.85 | -17.75 | 0 | 4 | 0 | 65 | 336.464 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.31 | 13.29 | -40.53 | 1 | 4 | 1 | 67 | 337.472 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
