COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK852421
Chemical Name: (2E)-N-[(2E)-5-({2-[(4-fluoro-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylprop-2-enamide
Smiles: O=C(Nc1ccc(c(c1)[N+](=O)[O-])F)CSc1n[nH]/c(=N\C(=O)/C=C/c2ccccc2)/s1

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Molecular Weight: 459.48
Empirical Formula: C19H14FN5O4S2

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 4.578
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 179
Number of rings: 3

     

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