COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL313515
Chemical Name: 3-{[4-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonyl)cyclohexyl]methyl}-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCN(CC1)C/C=C/c1ccccc1)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

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Molecular Weight: 471.6
Empirical Formula: C28H33N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.948
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 68
Number of rings: 5

     

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