| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 18 | No |
Popular Name: 4-(2,2-dimethoxyethyl)-5-phenyl-4H-1,2,4-triazole-3-thiol 4-(2,2-dimethoxyethyl)-5-phenyl-…
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CAS Number: 136745-20-5
| 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) | 2.23 | 6.46 | -45.48 | 0 | 5 | -1 | 49 | 264.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.51 | 6.61 | -10.12 | 1 | 5 | 0 | 52 | 265.338 | 5 | ↓ |
