COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL141939
Chemical Name: 2-methyl-3-(4-methylphenyl)-5-[(4-nitrophenyl)carbonyl]-2,3,5,6-tetrahydro-4H-2,6-methano-1,3,5-benzoxadiazocin-4-one
Smiles: Cc1ccc(cc1)N1C(=O)N(C2CC1(C)Oc1c2cccc1)C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 443.46
Empirical Formula: C25H21N3O5

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 4.027
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 95
Number of rings: 5

     

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