UCSF

ZINC67955462

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2011 26 Yes

Popular Name: (4R)-4-[4-(2-fluoro-6-isopropoxy-phenyl)phenyl]-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine (4R)-4-[4-(2-fluoro-6-isopropoxy…

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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) 4.44 10.45 -45.82 3 4 1 55 352.433 4 ↓
Hi High (pH 8-9.5) 4.44 9.38 -12.33 2 4 0 50 351.425 4 ↓
Lo Low (pH 4.5-6) 4.44 10.91 -105.25 4 4 2 56 353.441 4 ↓

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

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