COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK560993
Chemical Name: 1-[1-hydroxy-3-(3-nitrophenyl)-11-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Smiles: OC1=C2C(=Nc3c(N(C2c2ccccc2)C(=O)C)cccc3)CC(C1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 453.5
Empirical Formula: C27H23N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.069
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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