COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL391290
Chemical Name: methyl2-{[({(4E)-4-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-1-ethyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCN1C(=N/C(=C/c2cnn(c2C)C)/C1=O)SCC(=O)Nc1sc2c(c1C(=O)OC)CCCCC2

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Molecular Weight: 515.66
Empirical Formula: C24H29N5O4S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.339
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 159
Number of rings: 4

     

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