COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK821358
Chemical Name: 11-[(5Z)-4-oxo-5-{[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]undecanoicacid
Smiles: OC(=O)CCCCCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2cccs2)c2ccccc2)/C1=O

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Molecular Weight: 553.77
Empirical Formula: C28H31N3O3S3

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 6.938
Rotatable bonds: 14
H-donors: 1
H-acceptors: 3
PSA: 161
Number of rings: 4

     

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