COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK392587
Chemical Name: 11-(4-chlorophenyl)-3-(3-nitrophenyl)-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: Clc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccc(c2)[N+](=O)[O-])Nc2c(N1C(=O)C(F)(F)F)cccc2

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Molecular Weight: 541.91
Empirical Formula: C27H19ClF3N3O4

Physical State: Dry powder
Available Amount: 247 mg

Lipinsky:
logP: 6.515
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 95
Number of rings: 5

     

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