COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK950761
Chemical Name: 2-[(5Z)-5-{[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanedioicacid
Smiles: OC(=O)CC(N1C(=S)S/C(=C\c2ccc(o2)c2nc3c(s2)cccc3)/C1=O)C(=O)O

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Molecular Weight: 460.51
Empirical Formula: C19H12N2O6S3

Physical State: Dry powder
Available Amount: 328 mg

Lipinsky:
logP: 3.327
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 206
Number of rings: 4

     

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