COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL091371
Chemical Name: 1-(azepan-1-yl)-2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]ethanone
Smiles: O=C(N1CCCCCC1)CSc1[nH]c2c(n1)cc(c(c2)C)C

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Molecular Weight: 317.46
Empirical Formula: C17H23N3OS

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 4.615
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 74
Number of rings: 3

     

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