| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2008 | 33 | Yes |
Popular Name: (5S)-5-benzyl-2-(benzyl-(2-dimethylaminoethyl)amino)-3-(o-tolyl)-5H-imidazol-4-one (5S)-5-benzyl-2-(benzyl-(2-dimet…
| 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) | 4.78 | 18.14 | -100.84 | 2 | 5 | 2 | 42 | 442.607 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.78 | 15.81 | -30.96 | 1 | 5 | 1 | 41 | 441.599 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.78 | 14.58 | -7.92 | 0 | 5 | 0 | 39 | 440.591 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.31 | 16.37 | -15.72 | 1 | 5 | 0 | 49 | 440.591 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.31 | 18.9 | -65.27 | 2 | 5 | 1 | 50 | 441.599 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
