UCSF

ZINC39757819

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 27 Yes

Popular Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(5-isopropyl-1,3,4-thiadiazol-2-y 2-[[5-(3,4-dimethylphenyl)-4-met…

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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) 3.61 10.16 -20.39 1 7 0 86 402.549 6 ↓
Hi High (pH 8-9.5) 3.80 8.94 -52.75 0 7 -1 92 401.541 6 ↓

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