| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 17 | No |
Popular Name: 2-methylsulfanyl-N-[[2-(2-pyridyl)thiazol-4-yl]methyl]ethanamine 2-methylsulfanyl-N-[[2-(2-pyridy…
| 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) | 1.97 | 5.48 | -42.29 | 2 | 3 | 1 | 42 | 266.415 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | 4.11 | -9.36 | 1 | 3 | 0 | 38 | 265.407 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
