UCSF

ZINC01805289

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 26 No

Popular Name: 2-[[4-allyl-5-(2-amino-4-methyl-thiazol-5-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-acetamide 2-[[4-allyl-5-(2-amino-4-methyl-…

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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) 3.03 7.79 -13.73 3 7 0 99 392.554 7 ↓
Lo Low (pH 4.5-6) 3.03 8.22 -38.28 4 7 1 100 393.562 7 ↓
Lo Low (pH 4.5-6) 3.22 5.89 -35.32 4 7 1 103 393.562 7 ↓

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