COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL482839
Chemical Name: 3-[(4-chlorobenzyl)sulfanyl]-6-(1-methyl-1H-pyrrol-2-yl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: Clc1ccc(cc1)CSc1nnc2c(n1)OC(Nc1c2cccc1)c1cccn1C

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Molecular Weight: 435.94
Empirical Formula: C22H18ClN5OS

Physical State: Dry powder
Available Amount: 33 mg

Lipinsky:
logP: 4.319
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 90
Number of rings: 5

     

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