COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK014892
Chemical Name: (2E)-N-[5-({2-[(4-methylbenzyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylprop-2-enamide
Smiles: O=C(NCc1ccc(cc1)C)CSc1nnc(s1)NC(=O)/C=C/c1ccccc1

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Molecular Weight: 424.55
Empirical Formula: C21H20N4O2S2

Available Amount: 0 mg

Lipinsky:
logP: 4.776
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 137
Number of rings: 3

     

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