UCSF

ZINC39757599

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 31 Yes

Popular Name: 2-[[4-allyl-5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(5-ethyl-1,3,4-thiadiazol 2-[[4-allyl-5-[(3,4-dimethoxyphe…

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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) 2.54 9.78 -24.18 1 9 0 104 460.585 11 ↓
Hi High (pH 8-9.5) 2.73 8.59 -55.85 0 9 -1 110 459.577 11 ↓

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