COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK441974
Chemical Name: (2E)-N,3-bis(1,3-benzodioxol-5-yl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc2c(c1)OCO2)/C(=O)Nc1ccc2c(c1)OCO2

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Molecular Weight: 336.3
Empirical Formula: C18H12N2O5

Physical State: Dry powder
Available Amount: 573 mg

Lipinsky:
logP: 3.712
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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