UCSF

ZINC67172632

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2011 20 Yes

Popular Name: 1'-acetyl-4H-spiro[1,2,4-benzothiadiazine-3,4'-piperidine] 1,1-dioxide 1'-acetyl-4H-spiro[1,2,4-benzoth…

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CAS Numbers: 1325303-25-0 , [1325303-25-0]

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) 0.52 0.75 -20.23 2 6 0 79 295.364 0 ↓
Hi High (pH 8-9.5) 0.52 0.48 -48.51 1 6 -1 81 294.356 0 ↓

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

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