COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK665946
Chemical Name: ethyl4-({[4-(1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-methylfuran-2-carboxylate
Smiles: CCOC(=O)c1cc(c(o1)C)CSc1nnc(n1c1ccc2c(c1)OCO2)c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 553.59
Empirical Formula: C27H27N3O8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.644
Rotatable bonds: 8
H-donors: 0
H-acceptors: 8
PSA: 141
Number of rings: 5

     

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