COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL354633
Chemical Name: N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-2-{[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)nnc1c1ccccc1O

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Molecular Weight: 450.52
Empirical Formula: C22H22N6O3S

Physical State: Dry powder
Available Amount: 1084 mg

Lipinsky:
logP: 4.208
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 128
Number of rings: 4

     

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