COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK376510
Chemical Name: 2-[4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-methoxyphenoxy]-5-nitrobenzonitrile
Smiles: COc1cc(ccc1Oc1ccc(cc1C#N)[N+](=O)[O-])C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3

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Molecular Weight: 545.59
Empirical Formula: C33H27N3O5

Physical State: Dry powder
Available Amount: 225 mg

Lipinsky:
logP: 5.665
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 6

     

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