COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374668
Chemical Name: methyl4-{[(2E,5Z)-5-{[1-(2,3-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2cc(n(c2C)c2cccc(c2C)C)C)/C(=O)N1C

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Molecular Weight: 473.6
Empirical Formula: C27H27N3O3S

Physical State: Dry powder
Available Amount: 836 mg

Lipinsky:
logP: 7.494
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 4

     

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