COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL273900
Chemical Name: methyl4-({[3-(2-methoxyphenyl)-4-(1H-pyrrol-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)Cn1nc(n(c1=S)n1cccc1)c1ccccc1OC

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Molecular Weight: 463.52
Empirical Formula: C23H21N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.259
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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