COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551881
Chemical Name: (3'E)-7-chloro-3'-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}-4,6-dimethoxy-6'-methyl-2'H,3H,4'H-spiro[1-benzofuran-2,1'-cyclohexane]-2',3,4'-trione
Smiles: COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC(=O)/C(=C\NC2CCS(=O)(=O)C2)/C1=O)Cl

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Molecular Weight: 483.93
Empirical Formula: C21H22ClNO8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.706
Rotatable bonds: 3
H-donors: 1
H-acceptors: 8
PSA: 133
Number of rings: 4

     

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