COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080948
Chemical Name: 1-{1-hydroxy-3-(4-methoxyphenyl)-11-[4-(trifluoromethyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}propan-1-one
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N(C2c2ccc(cc2)C(F)(F)F)C(=O)CC)C1)O

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Molecular Weight: 520.55
Empirical Formula: C30H27F3N2O3

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 6.357
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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