UCSF

ZINC05847964

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 17th, 2006 15 Yes

Popular Name: butyl [(5-amino-4H-1,2,4-triazol-3-yl)thio]acetate butyl [(5-amino-4H-1,2,4-triazol…

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CAS Number: N/A

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) 1.41 5.67 -9.86 3 6 0 94 230.293 7 ↓

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