UCSF

ZINC67244864

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2011 27 Yes

Popular Name: 8-bromo-N-(4-methylbenzyl)-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzothiazine-4-carboxamide 5,5-dioxide 8-bromo-N-(4-methylbenzyl)-2,3-d…

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CAS Number: [1291871-25-4]

Other Names:

MFCD18788389

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) 3.66 7.38 -14.33 1 5 0 66 447.354 3 ↓

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

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