COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK365759
Chemical Name: methyl4-methyl-3,5-dinitrobenzoate
Smiles: COC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C

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Molecular Weight: 240.17
Empirical Formula: C9H8N2O6

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 1.839
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 1

     

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