COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK078222
Chemical Name: N-(cyanomethyl)-2-methyl-3-nitrobenzamide
Smiles: [O-][N+](=O)c1cccc(c1C)C(=O)NCC#N

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Molecular Weight: 219.2
Empirical Formula: C10H9N3O3

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 1.097
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 98
Number of rings: 1

     

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