COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK402321
Chemical Name: ethyl5-(azepan-1-ylcarbonyl)-4-methyl-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)N1CCCCCC1

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Molecular Weight: 459.52
Empirical Formula: C22H25N3O6S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 6.132
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 149
Number of rings: 3

     

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