COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120167
Chemical Name: (5E)-5-({5-[(4-chlorophenyl)sulfanyl]thiophen-2-yl}methylidene)-3-(cyclohexylmethyl)-1,3-thiazolidine-2,4-dione
Smiles: O=C1/C(=C\c2ccc(s2)Sc2ccc(cc2)Cl)/SC(=O)N1CC1CCCCC1

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Molecular Weight: 450.05
Empirical Formula: C21H20ClNO2S3

Physical State: Dry powder
Available Amount: 299 mg

Lipinsky:
logP: 8.174
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 116
Number of rings: 4

     

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