UCSF

ZINC67172585

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2011 25 No

Popular Name: tert-butyl 2-(3-fluorophenyl)-3-thioxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxylate tert-butyl 2-(3-fluorophenyl)-3-…

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CAS Numbers: 1325303-52-3 , [1325303-52-3]

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) 2.65 6.6 -9.79 1 5 0 54 363.458 3 ↓

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

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