| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 17 | Yes |
Popular Name: N-[[2-(azepan-1-yl)-4-methyl-thiazol-5-yl]methyl]ethanamine N-[[2-(azepan-1-yl)-4-methyl-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) | 2.90 | 7.82 | -38.64 | 2 | 3 | 1 | 33 | 254.423 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.90 | 6.45 | -4.9 | 1 | 3 | 0 | 28 | 253.415 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
