COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK732963
Chemical Name: 3-[(5Z)-5-{[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: OC(=O)CCN1C(=S)S/C(=C\c2ccc(o2)c2nc3c(s2)cccc3)/C1=O

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Molecular Weight: 416.5
Empirical Formula: C18H12N2O4S3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.968
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 169
Number of rings: 4

     

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