COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823578
Chemical Name: 3-[(5Z)-5-(4-tert-butylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(pyridin-3-ylmethyl)propanamide
Smiles: O=C(NCc1cccnc1)CCN1C(=S)S/C(=C\c2ccc(cc2)C(C)(C)C)/C1=O

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Molecular Weight: 439.6
Empirical Formula: C23H25N3O2S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.897
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 119
Number of rings: 3

     

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