UCSF

ZINC65310781

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 10th, 2011 29 Yes

Popular Name: 7-(4-fluoro-3-methyl-anilino)-2-[(4-methoxyphenyl)methyl]-5-methyl-[1,2,4]triazolo[4,3-a]pyrimidin-3 7-(4-fluoro-3-methyl-anilino)-2-…

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Physical Representations

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) 4.30 13.54 -16.27 1 7 0 73 393.422 5 ↓

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Rings

Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.