COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK559889
Chemical Name: 2,2,2-trifluoro-1-[3-(furan-2-yl)-1-hydroxy-11-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2cccc(c2)[N+](=O)[O-])C(=O)C(F)(F)F)cccc3)CC(C1)c1ccco1

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Molecular Weight: 497.43
Empirical Formula: C25H18F3N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.945
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 111
Number of rings: 5

     

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