COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK418997
Chemical Name: ethyl2-{[(4-tert-butylphenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)C(C)(C)C)sc2c1CCCCCC2

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Molecular Weight: 413.58
Empirical Formula: C24H31NO3S

Physical State: Dry powder
Available Amount: 823 mg

Lipinsky:
logP: 9.064
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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