In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 23rd, 2009 | 13 | Yes |
Popular Name: 4-Bromo-1-(pyridin-4-ylmethyl)pyrazole 4-Bromo-1-(pyridin-4-ylmethyl)py…
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CAS Numbers: 1179798-11-8 , [1179798-11-8]
4-((4-Bromo-1H-pyrazol-1-yl)methyl)pyridine
4-(4-Bromopyrazol-1-ylmethyl)pyridine
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) | 1.43 | 4.99 | -7.94 | 0 | 3 | 0 | 31 | 238.088 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 5.44 | -36.43 | 1 | 3 | 1 | 32 | 239.096 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.