COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741723
Chemical Name: 11-[(Z)-1-bromo-2-phenylethenyl]-3,3-dimethyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(/C(=C/c1ccccc1)/Br)N(c1c(N2)cccc1)C(=O)C(F)(F)F

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Molecular Weight: 519.36
Empirical Formula: C25H22BrF3N2O2

Physical State: Dry powder
Available Amount: 695 mg

Lipinsky:
logP: 6.933
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 49
Number of rings: 4

     

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