COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567529
Chemical Name: 5-(diethylammonio)-2-{(E)-[2-({[4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2[O-])[NH+](CC)CC)nnc1c1ccccc1

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Molecular Weight: 530.65
Empirical Formula: C28H30N6O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.15
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 134
Number of rings: 4

     

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