COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541903
Chemical Name: 3,7-bis[(2-nitrophenyl)carbonyl]-1,5-di(propan-2-yl)-3,7-diazabicyclo[3.3.1]nonan-9-one
Smiles: CC(C12CN(CC(C2=O)(CN(C1)C(=O)c1ccccc1[N+](=O)[O-])C(C)C)C(=O)c1ccccc1[N+](=O)[O-])C

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Molecular Weight: 522.56
Empirical Formula: C27H30N4O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.053
Rotatable bonds: 4
H-donors: 0
H-acceptors: 7
PSA: 149
Number of rings: 4

     

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