COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149595
Chemical Name: 2-{(E)-[2-({[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-5-(diethylammonio)phenolate
Smiles: CC[NH+](c1ccc(c(c1)[O-])/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccc1)CC

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Molecular Weight: 535.07
Empirical Formula: C27H27ClN6O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.83
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 124
Number of rings: 4

     

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