COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL166027
Chemical Name: N-(4-chlorophenyl)-2-methyl-8-nitro-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxamide
Smiles: S=C1NC2c3cc(ccc3OC(N1)(C2C(=O)Nc1ccc(cc1)Cl)C)[N+](=O)[O-]

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Molecular Weight: 418.86
Empirical Formula: C18H15ClN4O4S

Physical State: Dry powder
Available Amount: 37 mg

Lipinsky:
logP: 3.243
Rotatable bonds: 1
H-donors: 3
H-acceptors: 4
PSA: 140
Number of rings: 4

     

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