COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK532815
Chemical Name: 4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[2-(4-{4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperazin-1-yl)ethyl]butanamide
Smiles: O=C(CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O)NCCN1CCN(CC1)C(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/C1=O

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Molecular Weight: 736.02
Empirical Formula: C36H41N5O4S4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.694
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 208
Number of rings: 5

     

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