COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839957
Chemical Name: 2-({1-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=C(N1CCC(CC1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 468.51
Empirical Formula: C28H24N2O5

Physical State: Dry powder
Available Amount: 335 mg

Lipinsky:
logP: 3.59
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 76
Number of rings: 6

     

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