COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055191
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 530.65
Empirical Formula: C29H30N4O4S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 7.679
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 112
Number of rings: 5

     

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