UCSF

ZINC67561845

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 25 Yes

Popular Name: 4-[[(1R,5S)-3,8-diazabicyclo[3.2.1]octan-8-yl]methyl]-2-(3,4-dimethoxyphenyl)-5-methyl-oxazole 4-[[(1R,5S)-3,8-diazabicyclo[3.2…

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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) 1.73 3.14 -45.95 2 6 1 64 344.435 5 ↓
Hi High (pH 8-9.5) 1.73 2.08 -8.96 1 6 0 60 343.427 5 ↓

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Rings

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

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