COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305208
Chemical Name: ethyl2-{[({(4E)-1-(2-methylpropyl)-4-[(5-methylthiophen-2-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSC2=N/C(=C/c3ccc(s3)C)/C(=O)N2CC(C)C)sc2c1CCCCC2

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Molecular Weight: 559.77
Empirical Formula: C27H33N3O4S3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 8.616
Rotatable bonds: 9
H-donors: 1
H-acceptors: 4
PSA: 169
Number of rings: 4

     

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