COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091953
Chemical Name: 2,2,2-trifluoro-1-[1-hydroxy-11-(4-methoxyphenyl)-3-(4-methylphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)c1ccc(cc1)C

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Molecular Weight: 506.52
Empirical Formula: C29H25F3N2O3

Physical State: Dry powder
Available Amount: 418 mg

Lipinsky:
logP: 7.429
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 5

     

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