| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2010 | 30 | Yes |
Popular Name: N-[(1S)-1-[1-[4-(3,4-dimethylphenoxy)butyl]benzimidazol-2-yl]ethyl]butanamide N-[(1S)-1-[1-[4-(3,4-dimethylphe…
| 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) | 5.53 | 12.39 | -11.23 | 1 | 5 | 0 | 56 | 407.558 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.53 | 12.91 | -34.5 | 2 | 5 | 1 | 57 | 408.566 | 10 | ↓ |
Popular Name: N-[1-[1-[4-(3-methylphenoxy)butyl]benzoimidazol-2-yl]ethyl]formamide N-[1-[1-[4-(3-methylphenoxy)buty…
| 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) | 3.75 | -0.38 | -12.09 | 1 | 5 | 0 | 56 | 351.45 | 8 | ↓ |
Popular Name: N-[1-[1-[4-(3-methylphenoxy)butyl]benzoimidazol-2-yl]ethyl]formamide N-[1-[1-[4-(3-methylphenoxy)buty…
| 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) | 3.75 | -0.38 | -12.11 | 1 | 5 | 0 | 56 | 351.45 | 8 | ↓ |
