COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL475324
Chemical Name: 3-{2-[4-(2,4-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Smiles: COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)N1CCN(CC1)c1ccc(cc1C)C

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Molecular Weight: 449.55
Empirical Formula: C26H31N3O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 4.177
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 62
Number of rings: 4

     

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