COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823519
Chemical Name: 3-[(5Z)-5-(4-tert-butylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(3,4-dimethoxyphenyl)ethyl]propanamide
Smiles: COc1ccc(cc1OC)CCNC(=O)CCN1C(=S)S/C(=C\c2ccc(cc2)C(C)(C)C)/C1=O

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Molecular Weight: 512.69
Empirical Formula: C27H32N2O4S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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