UCSF

ZINC02863690

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2004 20 Yes

Popular Name: [4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzyl]-butyl-ammonium [4-(2-amino-2-keto-ethoxy)-3-chl…

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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) 2.12 -2.17 -57.13 4 5 1 78 301.794 9 ↓

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