| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 19 | Yes |
Popular Name: N-[[2-(ethylaminomethyl)thiazol-4-yl]methyl]-N,1-dimethyl-piperidin-4-amine N-[[2-(ethylaminomethyl)thiazol-…
| 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) | 1.00 | 4.97 | -80.66 | 3 | 4 | 2 | 37 | 284.473 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 3.59 | -36.03 | 2 | 4 | 1 | 33 | 283.465 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.00 | 7.5 | -166.14 | 4 | 4 | 3 | 38 | 285.481 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
