COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK038090
Chemical Name: 2,2,2-trifluoro-1-[1-hydroxy-3-(4-methoxyphenyl)-11-(3,4,5-trimethoxyphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3ccccc3N(C2c2cc(OC)c(c(c2)OC)OC)C(=O)C(F)(F)F)C1)O

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Molecular Weight: 582.58
Empirical Formula: C31H29F3N2O6

Physical State: Dry powder
Available Amount: 333 mg

Lipinsky:
logP: 6.408
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 89
Number of rings: 5

     

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