COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054007
Chemical Name: 3-(4-chlorophenyl)-11-[4-(dimethylamino)phenyl]-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Clc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)N(C)C)C(=O)C(F)(F)F

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Molecular Weight: 539.98
Empirical Formula: C29H25ClF3N3O2

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 6.894
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 5

     

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