COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL151009
Chemical Name: 1-[3-(4-tert-butylphenyl)-11-(2-chlorophenyl)-1-hydroxy-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]-2,2,2-trifluoroethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2ccccc2Cl)C(=O)C(F)(F)F)cccc3)CC(C1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 553.02
Empirical Formula: C31H28ClF3N2O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.337
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 5

     

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