| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 19 | No |
Popular Name: 5-(4-chlorophenyl)-4-(2-furylmethyl)-4H-1,2,4-triazole-3-thiol 5-(4-chlorophenyl)-4-(2-furylmet…
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CAS Number: 537017-38-2
| 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) | 3.82 | 8.97 | -43.19 | 0 | 4 | -1 | 44 | 290.755 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.09 | 9.12 | -10.54 | 1 | 4 | 0 | 47 | 291.763 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 117 - 119 | Enamine Building Blocks |
| MP | 117...119 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
