COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL355280
Chemical Name: methyl3-nitro-4-(pyrrolidin-1-yl)benzoate
Smiles: COC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1

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Molecular Weight: 250.25
Empirical Formula: C12H14N2O4

Physical State: Dry powder
Available Amount: 1571 mg

Lipinsky:
logP: 3.216
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 75
Number of rings: 2

     

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