COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK187563
Chemical Name: [3,5-bis(benzylamino)-1H-1,2,4-triazol-1-yl](3-nitrophenyl)methanone
Smiles: [O-][N+](=O)c1cccc(c1)C(=O)n1nc(nc1NCc1ccccc1)NCc1ccccc1

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Molecular Weight: 428.45
Empirical Formula: C23H20N6O3

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 4.117
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 117
Number of rings: 4

     

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