COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK637538
Chemical Name: (2E)-N-[(2Z)-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(/N=c\1/[nH]nc(s1)SCC(=O)N1CCN(CC1)c1ccccc1)/C=C/c1ccccc1

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Molecular Weight: 465.6
Empirical Formula: C23H23N5O2S2

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 3.959
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 127
Number of rings: 4

     

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