| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 18 | Yes |
Popular Name: 2-methoxy-N-[[2-(4-methylpiperazin-1-yl)-1H-imidazol-4-yl]methyl]ethanamine 2-methoxy-N-[[2-(4-methylpiperaz…
| 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) | 0.02 | 4.05 | -98.26 | 4 | 6 | 2 | 62 | 255.366 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.02 | 2.63 | -27.93 | 3 | 6 | 1 | 58 | 254.358 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.02 | 5.97 | -89.82 | 4 | 6 | 2 | 62 | 255.366 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.02 | 3.63 | -42.1 | 3 | 6 | 1 | 61 | 254.358 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.02 | 6.4 | -173.29 | 5 | 6 | 3 | 63 | 256.374 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
