| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 15 | Yes |
Popular Name: 2-imidazol-1-yl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]ethanamine 2-imidazol-1-yl-N-[(4-methyl-1,2…
| 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) | 0.10 | 4.38 | -66.89 | 2 | 6 | 1 | 73 | 208.245 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.10 | 3.02 | -14.96 | 1 | 6 | 0 | 69 | 207.237 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.10 | 4.89 | -123.32 | 3 | 6 | 2 | 75 | 209.253 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
