COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564832
Chemical Name: 3,3,7,8-tetramethyl-11-(4-nitrophenyl)-3,4,10,11-tetrahydro-2H-dibenzo[b,e][1,4]diazepin-1-ol
Smiles: OC1=C2C(=Nc3c(NC2c2ccc(cc2)[N+](=O)[O-])cc(c(c3)C)C)CC(C1)(C)C

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Molecular Weight: 391.47
Empirical Formula: C23H25N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.575
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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