COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK333749
Chemical Name: methyl2-[(azepan-1-ylcarbonothioyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2CCCCCC2)sc(c1c1ccccc1)C

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Molecular Weight: 388.55
Empirical Formula: C20H24N2O2S2

Physical State: Dry powder
Available Amount: 184 mg

Lipinsky:
logP: 5.935
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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