COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL473500
Chemical Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-one
Smiles: COc1cc2C=CN(C(=O)Cc2cc1OC)Cc1cc(Cl)cc2c1OCOC2

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Molecular Weight: 401.85
Empirical Formula: C21H20ClNO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.907
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 4

     

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