COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL064763
Chemical Name: methyl4-({[2-(azepan-1-ylcarbonyl)phenyl]carbamothioyl}amino)-4-oxobutanoate
Smiles: COC(=O)CCC(=O)NC(=S)Nc1ccccc1C(=O)N1CCCCCC1

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Molecular Weight: 391.49
Empirical Formula: C19H25N3O4S

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 2.236
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 119
Number of rings: 2

     

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