COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK403161
Chemical Name: 11-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: COc1cc(cc(c1O)Br)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cccs1

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Molecular Weight: 497.41
Empirical Formula: C24H21BrN2O3S

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.798
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 98
Number of rings: 5

     

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