COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192275
Chemical Name: 1-[3,5-bis(benzylamino)-1H-1,2,4-triazol-1-yl]-2-(3,4-dimethoxyphenyl)ethanone
Smiles: COc1cc(ccc1OC)CC(=O)n1nc(nc1NCc1ccccc1)NCc1ccccc1

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Molecular Weight: 457.53
Empirical Formula: C26H27N5O3

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 3.968
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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