COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157630
Chemical Name: methyl2-{3-[(E)-(3-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzoate
Smiles: COC(=O)c1ccccc1n1c(C)cc(c1C)/C=C\1/SC(=O)N(C1=O)CC(=O)Nc1ccc(c(c1)C)C

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Molecular Weight: 517.61
Empirical Formula: C28H27N3O5S

Physical State: Dry powder
Available Amount: 346 mg

Lipinsky:
logP: 6.255
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 123
Number of rings: 4

     

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