COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK192276
Chemical Name: (2E)-1-[3,5-bis(benzylamino)-1H-1,2,4-triazol-1-yl]-3-(4-chlorophenyl)prop-2-en-1-one
Smiles: Clc1ccc(cc1)/C=C/C(=O)n1nc(nc1NCc1ccccc1)NCc1ccccc1

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Molecular Weight: 443.94
Empirical Formula: C25H22ClN5O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.711
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 71
Number of rings: 4

     

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