COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038290
Chemical Name: 2-methyl-N-[(2E)-5-{2-[(2E)-2-{3-[2-(4-nitrophenoxy)ethoxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Smiles: O=C(Cc1n[nH]/c(=N\C(=O)c2ccccc2C)/s1)N/N=C/c1cccc(c1)OCCOc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 560.59
Empirical Formula: C27H24N6O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.116
Rotatable bonds: 9
H-donors: 2
H-acceptors: 6
PSA: 184
Number of rings: 4

     

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