COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL274113
Chemical Name: 6-(1,3-benzodioxol-5-ylamino)-3-[(4-chlorobenzyl)sulfanyl]-4-(1H-pyrrol-1-yl)-1,2,4-triazin-5(4H)-one
Smiles: Clc1ccc(cc1)CSc1nnc(c(=O)n1n1cccc1)Nc1ccc2c(c1)OCO2

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Molecular Weight: 453.91
Empirical Formula: C21H16ClN5O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.314
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 105
Number of rings: 5

     

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