COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL275023
Chemical Name: methyl4-({3-[(3-methylbenzyl)sulfanyl]-5-oxo-4-(1H-pyrrol-1-yl)-4,5-dihydro-1,2,4-triazin-6-yl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)Nc1nnc(n(c1=O)n1cccc1)SCc1cccc(c1)C

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Molecular Weight: 447.52
Empirical Formula: C23H21N5O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.384
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 4

     

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