COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566365
Chemical Name: 2-[(E)-(2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-2-ium-3-yl)sulfanyl]acetyl}hydrazinylidene)methyl]-4,6-diiodophenolate
Smiles: CCn1c(SCC(=O)N/N=C/c2cc(I)cc(c2[O-])I)[nH+]nc1c1ccccc1

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Molecular Weight: 633.25
Empirical Formula: C19H17I2N5O2S

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 7.915
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 121
Number of rings: 3

     

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