COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK401658
Chemical Name: ethyl2-chloro-5-nitrobenzoate
Smiles: [O-][N+](=O)c1cc(C(=O)OCC)c(cc1)Cl

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Molecular Weight: 229.62
Empirical Formula: C9H8ClNO4

Physical State: Liquid
Available Amount: 713 mg

Lipinsky:
logP: 2.691
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 72
Number of rings: 1

     

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