COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK770286
Chemical Name: (8Z)-3-ethoxy-2-nitro-8-(2,3,3-trichloro-1-nitroprop-2-en-1-ylidene)-7-azabicyclo[4.2.0]octa-1,3,5-triene
Smiles: CCOc1ccc2c(c1[N+](=O)[O-])/C(=C(\C(=C(Cl)Cl)Cl)/[N+](=O)[O-])/N2

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Molecular Weight: 380.57
Empirical Formula: C12H8Cl3N3O5

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 3.058
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 112
Number of rings: 2

     

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