COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK374990
Chemical Name: methyl(2E)-2-[(2Z)-2-(3-butyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)ethylidene]-3-ethyl-1-methyl-2,3-dihydro-1H-benzimidazole-5-carboxylate
Smiles: CCCCN1C(=S)S/C(=C\C=c\2/n(C)c3c(n2CC)cc(cc3)C(=O)OC)/C1=O

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Molecular Weight: 431.58
Empirical Formula: C21H25N3O3S2

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.199
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 110
Number of rings: 3

     

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