| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 34 | Yes |
Popular Name: (5R)-5-benzyl-2-(4-benzylpiperazin-1-yl)-3-(3-ethylphenyl)-5H-imidazol-4-one (5R)-5-benzyl-2-(4-benzylpiperaz…
| 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) | 5.13 | 15.94 | -9.87 | 1 | 5 | 0 | 41 | 453.61 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 16.63 | -15.15 | 1 | 5 | 0 | 49 | 452.602 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 18.95 | -64.04 | 2 | 5 | 1 | 50 | 453.61 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 14.45 | -33.1 | 2 | 5 | 1 | 50 | 453.61 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 5.13 | 18.15 | -59.32 | 2 | 5 | 0 | 42 | 454.618 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
