COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK022665
Chemical Name: 11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1Nc2ccccc2NC2=C1C(=O)CC(C2)(C)C

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Molecular Weight: 503.04
Empirical Formula: C30H31ClN2O3

Physical State: Dry powder
Available Amount: 435 mg

Lipinsky:
logP: 5.93
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 59
Number of rings: 5

     

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