UCSF

ZINC09708509

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2007 27 Yes

Popular Name: 4-phenylsulfonyl-8-(2-thienylsulfonyl)-1-oxa-4,8-diazaspiro[4.5]decane 4-phenylsulfonyl-8-(2-thienylsul…

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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) 2.43 2.89 -14.97 0 7 0 84 428.557 4 ↓

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Rings

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

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