COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541829
Chemical Name: N-{[4-(3,4-dimethoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}-3,5-dinitrobenzamide
Smiles: COc1cc(ccc1OC)C1(CCOCC1)CNC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

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Molecular Weight: 445.43
Empirical Formula: C21H23N3O8

Physical State: Dry powder
Available Amount: 235 mg

Lipinsky:
logP: 2.534
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 148
Number of rings: 3

     

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