COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322187
Chemical Name: 1,1'-[1-benzyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl]dioctan-1-one
Smiles: CCCCCCCC(=O)C1=CN(Cc2ccccc2)C=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CCCCCCC

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Molecular Weight: 544.73
Empirical Formula: C34H44N2O4

Physical State: Dry powder
Available Amount: 123 mg

Lipinsky:
logP: 9.079
Rotatable bonds: 15
H-donors: 0
H-acceptors: 4
PSA: 83
Number of rings: 3

     

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