| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 16 | Yes |
Popular Name: 2-(2-methylimidazol-1-yl)-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]ethanamine 2-(2-methylimidazol-1-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) | -0.65 | 3.08 | -60.53 | 2 | 6 | 1 | 73 | 222.272 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.65 | 2.2 | -35.6 | 2 | 6 | 1 | 70 | 222.272 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.65 | 1.72 | -11.87 | 1 | 6 | 0 | 69 | 221.264 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.65 | 3.56 | -109.8 | 3 | 6 | 2 | 75 | 223.28 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
