COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113548
Chemical Name: (2E,5E)-5-(1,3-benzodioxol-5-ylmethylidene)-2-(phenylimino)-3-(pyridin-3-ylmethyl)-1,3-thiazolidin-4-one
Smiles: O=C1/C(=C\c2ccc3c(c2)OCO3)/S/C(=N/c2ccccc2)/N1Cc1cccnc1

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Molecular Weight: 415.47
Empirical Formula: C23H17N3O3S

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 4.903
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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