UCSF

ZINC70006588

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 2nd, 2011 16 No

Popular Name: [(1S,5R)-3-chloro-8-azabicyclo[3.2.1]octan-8-yl]-[(3S)-tetrahydrothiophen-3-yl]methanone [(1S,5R)-3-chloro-8-azabicyclo[3…

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Download: MOL2 SDF SMILES Flexibase

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) 2.06 7.47 -9.75 0 2 0 20 259.802 1 ↓

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Rings

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

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