In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 21 | Yes |
Popular Name: 5-(3-fluoro-4-methoxyphenyl)-6-methyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine 5-(3-fluoro-4-methoxyphenyl)-6-m…
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CAS Number: 861210-14-2
2-fluoro-4-[6-methyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidin-5-yl]phenyl methyl ether
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) | 3.18 | 9.11 | -13.87 | 0 | 5 | 0 | 52 | 304.35 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 220 - 222 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.