COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK693813
Chemical Name: 4,5-dimethoxy-6-[(1E)-2-nitroprop-1-en-1-yl]-1,3-benzodioxole
Smiles: COc1c(cc2c(c1OC)OCO2)/C=C(/[N+](=O)[O-])\C

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Molecular Weight: 267.24
Empirical Formula: C12H13NO6

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 2.956
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 82
Number of rings: 2

     

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