| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 20 | Yes |
Popular Name: N-[[2-(azepan-1-yl)-4-propyl-thiazol-5-yl]methyl]propan-1-amine N-[[2-(azepan-1-yl)-4-propyl-thi…
| 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) | 4.48 | 10.12 | -39.25 | 2 | 3 | 1 | 33 | 296.504 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.48 | 8.72 | -4.77 | 1 | 3 | 0 | 28 | 295.496 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
