COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK137299
Chemical Name: 1,3-dimethyl-5-(3-nitrophenyl)-11-pentanoyl-5,11-dihydro-1H-indeno[2',1':5,6]pyrido[2,3-d]pyrimidine-2,4,6(3H)-trione
Smiles: CCCCC(=O)N1C2=C(C(=O)c3c2cccc3)C(c2c1n(C)c(=O)n(c2=O)C)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 500.51
Empirical Formula: C27H24N4O6

Physical State: Dry powder
Available Amount: 425 mg

Lipinsky:
logP: 5.418
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 123
Number of rings: 5

     

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