COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003056
Chemical Name: (2Z,5Z)-3-ethyl-2-(ethylimino)-5-{[1-(3-iodophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1,3-thiazolidin-4-one
Smiles: CC/N=C/1\S/C(=C\c2cc(n(c2C)c2cccc(c2)I)C)/C(=O)N1CC

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Molecular Weight: 479.38
Empirical Formula: C20H22IN3OS

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 5.236
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 62
Number of rings: 3

     

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