| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 18 | Yes |
Popular Name: 1-[4-[[cyclohexylmethyl(methyl)amino]methyl]thiazol-2-yl]-N-methyl-methanamine 1-[4-[[cyclohexylmethyl(methyl)a…
| 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) | 2.49 | 7.75 | -92.14 | 3 | 3 | 2 | 34 | 269.458 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 4.25 | -3.86 | 1 | 3 | 0 | 28 | 267.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.49 | 6.31 | -34.3 | 2 | 3 | 1 | 29 | 268.45 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
