COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK346244
Chemical Name: 3-[4-({4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}carbonyl)phenyl]-2H-chromen-2-one
Smiles: O=C(c1ccc(cc1)c1cc2ccccc2oc1=O)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[N+](=O)[O-]

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Molecular Weight: 538.6
Empirical Formula: C31H30N4O5

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 5.965
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 98
Number of rings: 6

     

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