UCSF

ZINC19913508

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 35 Yes

Popular Name: 2-[[5-(4-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-benzylpiperazin-1-yl)ethanone 2-[[5-(4-aminophenyl)-4-phenyl-1…

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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) 3.49 11.89 -16.02 2 7 0 80 484.629 7 ↓

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