UCSF

ZINC01705552

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 18 Yes

Popular Name: 3-Benzyl-3,9-diazaspiro[5.5]undecane 3-Benzyl-3,9-diazaspiro[5.5]unde…

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CAS Numbers: 1171506-89-0 , 189333-49-1

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) 2.05 8.38 -95.37 3 2 2 21 246.398 2 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem

Activity (Go SEA)

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