COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK136691
Chemical Name: dimethyl5-({[3-nitro-4-(pyrrolidin-1-yl)phenyl]carbonyl}amino)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCCC1

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Molecular Weight: 427.41
Empirical Formula: C21H21N3O7

Physical State: Dry powder
Available Amount: 54 mg

Lipinsky:
logP: 4.859
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 130
Number of rings: 3

     

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