COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667180
Chemical Name: (3s,5s,7s)-N-{(5E)-4-oxo-5-[4-(2-phenylethoxy)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)NN1C(=S)S/C(=C/c2ccc(cc2)OCCc2ccccc2)/C1=O

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Molecular Weight: 518.7
Empirical Formula: C29H30N2O3S2

Physical State: Dry powder
Available Amount: 447 mg

Lipinsky:
logP: 6.849
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 7

     

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