COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK574133
Chemical Name: (2E)-N-[(2Z)-5-({2-[(4-methylbenzyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(NCc1ccc(cc1)C)CSc1n[nH]/c(=N/C(=O)/C=C/c2ccccc2)/s1

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Molecular Weight: 424.55
Empirical Formula: C21H20N4O2S2

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.329
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 133
Number of rings: 3

     

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