| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 19 | No |
Popular Name: 5-(4-methylpiperidin-1-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol 5-(4-methylpiperidin-1-yl)-4-(te…
Find On: PubMed — Wikipedia — Google
CAS Number: 923254-10-8
| 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) | 1.39 | 7.86 | -11.66 | 1 | 5 | 0 | 46 | 282.413 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 9.44 | -47.73 | 1 | 5 | 0 | 44 | 282.413 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.12 | 7.71 | -48.73 | 0 | 5 | -1 | 43 | 281.405 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
