COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK756086
Chemical Name: 2,2-dimethyl-5-(6-nitro-1,3-benzodioxol-5-yl)-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Smiles: O=C1CC(C)(C)CC2=C1C(Nc1c2c2ccccc2cc1)c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 442.47
Empirical Formula: C26H22N2O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.724
Rotatable bonds: 1
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 6

     

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