COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053280
Chemical Name: 3-(3,4-dimethoxyphenyl)-11-(3-ethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cccc(c1)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(c(c1)OC)OC

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Molecular Weight: 470.57
Empirical Formula: C29H30N2O4

Physical State: Dry powder
Available Amount: 505 mg

Lipinsky:
logP: 4.227
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 68
Number of rings: 5

     

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