COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL251840
Chemical Name: 1,3-dimethyl-5-[(Z)-{2-oxo-4-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5(2H)-ylidene}methyl]-1,3-dihydro-2H-benzimidazol-2-one
Smiles: COc1cc(NC2=NC(=O)S/C/2=C\c2ccc3c(c2)n(C)c(=O)n3C)cc(c1OC)OC

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Molecular Weight: 454.51
Empirical Formula: C22H22N4O5S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.454
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 118
Number of rings: 4

     

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