| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 21 | Yes |
Popular Name: 4-methoxy-3-[[methyl-[(1-methylimidazol-2-yl)methyl]amino]methyl]benzoic 4-methoxy-3-[[methyl-[(1-methyli…
| 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) | 1.20 | 5.76 | -52.91 | 0 | 6 | -1 | 70 | 288.327 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.20 | 6.4 | -64.91 | 1 | 6 | 0 | 72 | 289.335 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.20 | 8.11 | -61.48 | 1 | 6 | 0 | 72 | 289.335 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
