COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378095
Chemical Name: 3,3,7,8-tetramethyl-11-(6-nitro-1,3-benzodioxol-5-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cc(c(c1)C)C)c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 435.48
Empirical Formula: C24H25N3O5

Physical State: Dry powder
Available Amount: 395 mg

Lipinsky:
logP: 4.332
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 105
Number of rings: 5

     

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