COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK679108
Chemical Name: 10-butyl-1-(2,4-dibromophenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: CCCCN1C(=O)c2c(Oc3ccc(cc3Br)Br)cc(cc2Oc2c1cccc2)[N+](=O)[O-]

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Molecular Weight: 562.21
Empirical Formula: C23H18Br2N2O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.036
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 84
Number of rings: 4

     

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