COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK395669
Chemical Name: methyl3-carbamoyl-5-nitrobenzoate
Smiles: COC(=O)c1cc(cc(c1)C(=O)N)[N+](=O)[O-]

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Molecular Weight: 224.17
Empirical Formula: C9H8N2O5

Physical State: Dry powder
Available Amount: 51 mg

Lipinsky:
logP: 0.821
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 115
Number of rings: 1

     

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