COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK403454
Chemical Name: 11-(3-bromo-5-ethoxy-4-methoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cc(cc(c1OC)Br)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cccs1

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Molecular Weight: 525.47
Empirical Formula: C26H25BrN2O3S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 4.681
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 87
Number of rings: 5

     

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