COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374396
Chemical Name: {2-chloro-4-[(Z)-{(2E)-2-[(4-ethoxyphenyl)imino]-3-ethyl-4-oxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}aceticacid
Smiles: CCOc1ccc(cc1)/N=C\1/S/C(=C\c2ccc(c(c2)Cl)OCC(=O)O)/C(=O)N1CC

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Molecular Weight: 460.94
Empirical Formula: C22H21ClN2O5S

Physical State: Dry powder
Available Amount: 1266 mg

Lipinsky:
logP: 5.033
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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