In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 29 | Yes |
Popular Name: (5S)-5-benzyl-2-(2-dimethylaminoethyl-ethyl-amino)-3-(3-ethylphenyl)-5H-imidazol-4-one (5S)-5-benzyl-2-(2-dimethylamino…
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) | 4.25 | 15.95 | -99.22 | 2 | 5 | 2 | 42 | 394.563 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 13.49 | -28.38 | 1 | 5 | 1 | 41 | 393.555 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.25 | 12.55 | -7.32 | 0 | 5 | 0 | 39 | 392.547 | 9 | ↓ |
Hi High (pH 8-9.5) | 1.78 | 14.33 | -15.76 | 1 | 5 | 0 | 49 | 392.547 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 16.87 | -61.85 | 2 | 5 | 1 | 50 | 393.555 | 9 | ↓ |