COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850998
Chemical Name: (2E)-N-[(2Z)-5-({2-[(4-acetylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1n[nH]/c(=N/C(=O)/C=C/c2ccccc2)/s1

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Molecular Weight: 438.53
Empirical Formula: C21H18N4O3S2

Physical State: Dry powder
Available Amount: 266 mg

Lipinsky:
logP: 4.27
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 150
Number of rings: 3

     

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