COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL232113
Chemical Name: methyl4-{(E)-[(2E)-2-{2-[(4-chlorophenyl)amino]-1-cyano-2-oxoethylidene}-4-oxo-3-phenyl-1,3-thiazolidin-5-ylidene]methyl}benzoate
Smiles: N#C/C(=c/1\s/c(=C/c2ccc(cc2)C(=O)OC)/c(=O)n1c1ccccc1)/C(=O)Nc1ccc(cc1)Cl

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Molecular Weight: 515.98
Empirical Formula: C27H18ClN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.774
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 124
Number of rings: 4

     

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