COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK064317
Chemical Name: N,N-bis(cyanomethyl)-4,5-dimethoxy-2-nitrobenzamide
Smiles: COc1cc(C(=O)N(CC#N)CC#N)c(cc1OC)[N+](=O)[O-]

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Molecular Weight: 304.26
Empirical Formula: C13H12N4O5

Physical State: Dry powder
Available Amount: 282 mg

Lipinsky:
logP: 0.75
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 132
Number of rings: 1

     

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