COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379084
Chemical Name: ethyl3-{5-[(E)-(4-oxo-2-thioxo-3-{[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl]amino}-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoate
Smiles: CCOC(=O)c1cccc(c1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)NC(=O)C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3

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Molecular Weight: 536.67
Empirical Formula: C28H28N2O5S2

Physical State: Dry powder
Available Amount: 1598 mg

Lipinsky:
logP: 6.943
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 146
Number of rings: 7

     

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