COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK394207
Chemical Name: 2-methoxy-4-{(E)-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]decane-1-carboxylate
Smiles: C=CCN1C(=S)S/C(=C/c2ccc(c(c2)OC)OC(=O)C23C[C@@H]4C[C@H](C3)C[C@H](C2)C4)/C1=O

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Molecular Weight: 469.63
Empirical Formula: C25H27NO4S2

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.939
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 6

     

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