| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2010 | 17 | Yes |
Popular Name: (1S)-1-(2,5-dimethyl-3-furyl)-N-[(4-methyl-1H-imidazol-5-yl)methyl]ethanamine (1S)-1-(2,5-dimethyl-3-furyl)-N-…
| 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) | 1.29 | 6.48 | -37.35 | 3 | 4 | 1 | 58 | 234.323 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.29 | 5.26 | -9.34 | 2 | 4 | 0 | 54 | 233.315 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.29 | 7.01 | -105.19 | 4 | 4 | 2 | 60 | 235.331 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
