COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK403317
Chemical Name: 11-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1cc(Br)c(c(c1)OC)O

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Molecular Weight: 581.46
Empirical Formula: C29H29BrN2O6

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 3.559
Rotatable bonds: 5
H-donors: 3
H-acceptors: 6
PSA: 98
Number of rings: 5

     

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