UCSF

ZINC69976360

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2011 14 No

Popular Name: 4-(chloromethyl)-2-[(1R,4S,5R)-7-oxabicyclo[2.2.1]heptan-5-yl]-1H-imidazole 4-(chloromethyl)-2-[(1R,4S,5R)-7…

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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) 1.31 4.3 -7.78 1 3 0 38 212.68 2 ↓
Lo Low (pH 4.5-6) 1.31 4.65 -33.58 2 3 1 39 213.688 2 ↓

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

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