| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 21 | Yes |
Popular Name: (S)-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]-phenyl-methanamine (S)-[5-(3,4-dimethylphenyl)-1H-i…
| 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) | 3.49 | 7.84 | -52.66 | 4 | 3 | 1 | 56 | 278.379 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 7.89 | -30.89 | 4 | 3 | 1 | 56 | 278.379 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 7.54 | -8.78 | 3 | 3 | 0 | 55 | 277.371 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.49 | 8.23 | -123.42 | 5 | 3 | 2 | 58 | 279.387 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
