COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374424
Chemical Name: (2E,5Z)-5-{[2,5-dimethyl-1-(2-methylphenyl)-1H-pyrrol-3-yl]methylidene}-2-[(4-ethoxyphenyl)imino]-3-ethyl-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C\1/S/C(=C\c2cc(n(c2C)c2ccccc2C)C)/C(=O)N1CC

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Molecular Weight: 459.61
Empirical Formula: C27H29N3O2S

Physical State: Dry powder
Available Amount: 1342 mg

Lipinsky:
logP: 7.567
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 72
Number of rings: 4

     

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