UCSF

ZINC39258494

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 12 Yes

Popular Name: 1-bicyclo[2.2.2]octanyl 1-bicyclo[2.2.2]octanyl

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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) 2.34 6.35 -4.76 0 2 0 26 168.236 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US4036977; US4120899; US4130561; US4200588 IBM Patent Data

Activity (Go SEA)

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