| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 16 | Yes |
Popular Name: [4-[(4-ethyl-1-piperidyl)methyl]thiazol-2-yl]methanamine [4-[(4-ethyl-1-piperidyl)methyl]…
| 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) | 1.66 | 5.03 | -94.91 | 4 | 3 | 2 | 45 | 241.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 2.35 | -4.97 | 2 | 3 | 0 | 42 | 239.388 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 4.63 | -33 | 3 | 3 | 1 | 43 | 240.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
