COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK646169
Chemical Name: N-[(2Z)-5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenyl-5,6-dihydro-1,4-oxathiine-2-carboxamide
Smiles: Clc1ccccc1CSc1n[nH]/c(=N/C(=O)C2=C(SCCO2)c2ccccc2)/s1

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Molecular Weight: 462.02
Empirical Formula: C20H16ClN3O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.684
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 138
Number of rings: 4

     

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