UCSF

ZINC20882285

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 36 Yes

Popular Name: (2S)-2-[[5-benzyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl (2S)-2-[[5-benzyl-4-(4-ethoxyphe…

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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) 5.26 16.97 -12.4 0 6 0 60 498.652 8 ↓

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