| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 20 | No |
Popular Name: 3-chloro-2-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-5-(trifluoromethyl)pyridine 3-chloro-2-[(3-nitro-1H-1,2,4-tr…
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CAS Number: 1092346-59-2
| 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) | 2.06 | 9.42 | -13.58 | 0 | 7 | 0 | 89 | 307.619 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 126 - 128 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
