COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037404
Chemical Name: 2-{(E)-[2-({[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-5-(diethylammonio)phenolate
Smiles: COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2[O-])[NH+](CC)CC)nnc1c1ccc(cc1)OC

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Molecular Weight: 560.68
Empirical Formula: C29H32N6O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.317
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 143
Number of rings: 4

     

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