COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK227647
Chemical Name: (2E)-3-phenyl-1-[5-{[4-(propan-2-yl)benzyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]prop-2-en-1-one
Smiles: CC(c1ccc(cc1)CNc1nc(nn1C(=O)/C=C/c1ccccc1)c1cccnc1)C

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Saltdata: HCl
Molecular Weight: 423.52
Empirical Formula: C26H25N5O

Physical State: Dry powder
Available Amount: 173 mg

Lipinsky:
logP: 6.043
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 72
Number of rings: 4

     

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