COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL300029
Chemical Name: 2-({1-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]piperidin-4-yl}methyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: COc1cc(/C=C/C(=O)N2CCC(CC2)Cn2c(=O)c3cccc4c3c(c2=O)ccc4)ccc1OC

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Molecular Weight: 484.55
Empirical Formula: C29H28N2O5

Physical State: Dry powder
Available Amount: 242 mg

Lipinsky:
logP: 3.296
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 76
Number of rings: 5

     

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