COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK039046
Chemical Name: 11-(2-bromo-4,5-dimethoxyphenyl)-3-(4-methoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cc(OC)c(cc1Br)OC

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Molecular Weight: 535.44
Empirical Formula: C28H27BrN2O4

Physical State: Dry powder
Available Amount: 814 mg

Lipinsky:
logP: 4.847
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 68
Number of rings: 5

     

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