| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 18 | No |
Popular Name: 1-(1-methylimidazol-2-yl)-N-[(3-nitrophenyl)methyl]methanamine 1-(1-methylimidazol-2-yl)-N-[(3-…
| 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) | 0.99 | 6.45 | -38.56 | 2 | 6 | 1 | 77 | 247.278 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 5.99 | -15.85 | 1 | 6 | 0 | 76 | 246.27 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.99 | 7.8 | -129.95 | 3 | 6 | 2 | 82 | 248.286 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
