COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK449522
Chemical Name: 6-(difluoromethyl)-2-({5-[(Z)-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxybenzyl}sulfanyl)-4-methylpyridine-3-carbonitrile
Smiles: CCN1C(=S)S/C(=C\c2ccc(c(c2)CSc2nc(cc(c2C#N)C)C(F)F)OC)/C1=O

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Molecular Weight: 491.61
Empirical Formula: C22H19F2N3O2S3

Physical State: Dry powder
Available Amount: 430 mg

Lipinsky:
logP: 3.741
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 148
Number of rings: 3

     

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