UCSF

ZINC39758888

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2010 32 Yes

Popular Name: 2-[[4-allyl-5-[(3,4-dimethoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(5-cyclopropyl-1,3,4-thia 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) 2.34 10.6 -23.56 1 9 0 104 472.596 11 ↓
Hi High (pH 8-9.5) 2.52 9.4 -55.51 0 9 -1 110 471.588 11 ↓

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