COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK124024
Chemical Name: N,N-bis(cyanomethyl)-2-methyl-3-nitrobenzamide
Smiles: N#CCN(C(=O)c1cccc(c1C)[N+](=O)[O-])CC#N

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Molecular Weight: 258.24
Empirical Formula: C12H10N4O3

Physical State: Dry powder
Available Amount: 232 mg

Lipinsky:
logP: 0.157
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 113
Number of rings: 1

     

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