COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL309646
Chemical Name: 3-(6-oxo-6-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}hexyl)-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCN(CC1)C/C=C/c1ccccc1)CCCCCn1nnc2c(c1=O)cccc2

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Molecular Weight: 445.56
Empirical Formula: C26H31N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.522
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 68
Number of rings: 4

     

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