| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 19 | Yes |
Popular Name: N-[(1R)-1-[2-(azepan-1-yl)-4-methyl-thiazol-5-yl]ethyl]propan-1-amine N-[(1R)-1-[2-(azepan-1-yl)-4-met…
| 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) | 3.96 | 9.06 | -36.87 | 2 | 3 | 1 | 33 | 282.477 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.96 | 7.85 | -4.55 | 1 | 3 | 0 | 28 | 281.469 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
