COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL300060
Chemical Name: 2-({1-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: Fc1ccc(cc1)/C=C/C(=O)N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 442.49
Empirical Formula: C27H23FN2O3

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 3.478
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 57
Number of rings: 5

     

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