| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 18 | No |
Popular Name: 5-piperidin-1-yl-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol 5-piperidin-1-yl-4-(tetrahydrofu…
Find On: PubMed — Wikipedia — Google
CAS Number: 923124-24-7
| 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) | 1.15 | 7.47 | -12.64 | 1 | 5 | 0 | 46 | 268.386 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 8.87 | -48.46 | 1 | 5 | 0 | 44 | 268.386 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 7.31 | -50.66 | 0 | 5 | -1 | 43 | 267.378 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
