COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK124476
Chemical Name: 2-[(4-chlorophenyl)amino]-2-oxoethyl[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate
Smiles: CCn1c2ccccc2c2c1nc(SCC(=O)OCC(=O)Nc1ccc(cc1)Cl)nn2

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Molecular Weight: 455.92
Empirical Formula: C21H18ClN5O3S

Physical State: Dry powder
Available Amount: 179 mg

Lipinsky:
logP: 5.075
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 124
Number of rings: 4

     

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