COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK013103
Chemical Name: 3-{[(5-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}-2H-chromen-2-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc(s1)SCC(=O)c1cc2ccccc2oc1=O

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Molecular Weight: 533.45
Empirical Formula: C21H13BrN2O4S3

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 6.311
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 165
Number of rings: 4

     

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