COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL274341
Chemical Name: methyl4-({3-[(3-methoxybenzyl)sulfanyl]-5-oxo-4-(1H-pyrrol-1-yl)-4,5-dihydro-1,2,4-triazin-6-yl}amino)benzoate
Smiles: COc1cccc(c1)CSc1nnc(c(=O)n1n1cccc1)Nc1ccc(cc1)C(=O)OC

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Molecular Weight: 463.52
Empirical Formula: C23H21N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.839
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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