COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL170793
Chemical Name: 11-[5-(4-bromophenyl)furan-2-yl]-3,3-dimethyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Brc1ccc(cc1)c1ccc(o1)C1C2=C(Nc3c(N1C(=O)C(F)(F)F)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 559.38
Empirical Formula: C27H22BrF3N2O3

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 7.412
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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