| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 19 | Yes |
Popular Name: (1R)-1-(benzofuran-2-yl)-N'-(3-methoxypropyl)-N'-methyl-ethane-1,2-diamine (1R)-1-(benzofuran-2-yl)-N'-(3-m…
| 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) | 0.28 | 3.82 | -41.78 | 3 | 4 | 1 | 53 | 263.361 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.28 | 3.41 | -5.92 | 2 | 4 | 0 | 52 | 262.353 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 5.79 | -129.31 | 4 | 4 | 2 | 54 | 264.369 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 5.4 | -37.85 | 3 | 4 | 1 | 53 | 263.361 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
