In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 25 | Yes |
Popular Name: 4-[[2-(1-ethylpropyl)-5,6-dimethyl-benzimidazol-1-yl]methyl]benzonitrile 4-[[2-(1-ethylpropyl)-5,6-dimeth…
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) | 5.48 | 13.21 | -12.97 | 0 | 3 | 0 | 42 | 331.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.48 | 13.64 | -34.59 | 1 | 3 | 1 | 43 | 332.471 | 5 | ↓ |