COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK134847
Chemical Name: 3,3-dimethyl-11-(3-propoxyphenyl)-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: CCCOc1cccc(c1)C1C2=C(Nc3c(N1C(=O)C(F)(F)F)cccc3)CC(CC2=O)(C)C

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Molecular Weight: 472.51
Empirical Formula: C26H27F3N2O3

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 6.536
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 58
Number of rings: 4

     

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