COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK419319
Chemical Name: methyl2-{[4-(4-chloro-2-methylphenoxy)butanoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CCCOc2ccc(cc2C)Cl)sc2c1CCCCCC2

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Molecular Weight: 450
Empirical Formula: C23H28ClNO4S

Physical State: Dry powder
Available Amount: 3219 mg

Lipinsky:
logP: 7.842
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 3

     

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