COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549999
Chemical Name: 4-({(Z)-[(2R,6'R)-7-chloro-4,6-dimethoxy-6'-methyl-2',3,4'-trioxo-3H,3'H-spiro[1-benzofuran-2,1'-cyclohexan]-3'-ylidene]methyl}amino)-N-(1,3-thiazol-2-yl)benzamide
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC(=O)/C(=C/Nc2ccc(cc2)C(=O)Nc2nccs2)/C1=O)Cl

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Molecular Weight: 568.01
Empirical Formula: C27H22ClN3O7S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.938
Rotatable bonds: 2
H-donors: 2
H-acceptors: 7
PSA: 161
Number of rings: 5

     

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