COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561908
Chemical Name: 1-{3-(3,4-dimethoxyphenyl)-1-hydroxy-11-[4-(trifluoromethyl)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-2,2,2-trifluoroethanone
Smiles: COc1cc(ccc1OC)C1CC(=C2C(=Nc3ccccc3N(C2c2ccc(cc2)C(F)(F)F)C(=O)C(F)(F)F)C1)O

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Molecular Weight: 590.52
Empirical Formula: C30H24F6N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.362
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 5

     

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