COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK641435
Chemical Name: 3-phenyl-N-[(2Z)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-1,3,4-thiadiazol-2(3H)-ylidene]-5,6-dihydro-1,4-oxathiine-2-carboxamide
Smiles: O=C(C1=C(SCCO1)c1ccccc1)/N=c\1/[nH]nc(s1)SC/C=C/c1ccccc1

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Molecular Weight: 453.61
Empirical Formula: C22H19N3O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.693
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 138
Number of rings: 4

     

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