COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL274265
Chemical Name: 3-[(2-methoxybenzyl)sulfanyl]-6-[(4-nitrophenyl)amino]-4-(1H-pyrrol-1-yl)-1,2,4-triazin-5(4H)-one
Smiles: COc1ccccc1CSc1nnc(c(=O)n1n1cccc1)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 450.48
Empirical Formula: C21H18N6O4S

Available Amount: 0 mg

Lipinsky:
logP: 3.887
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 142
Number of rings: 4

     

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