COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL032046
Chemical Name: 3-phenyl-1-{3-(pyridin-3-yl)-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}propan-1-one
Smiles: O=C(n1nc(nc1NCc1cccs1)c1cccnc1)CCc1ccccc1

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Molecular Weight: 389.48
Empirical Formula: C21H19N5OS

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 3.842
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 100
Number of rings: 4

     

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