COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK469955
Chemical Name: (2Z)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-{5-[(4-nitrophenoxy)methyl]furan-2-yl}prop-2-enamide
Smiles: N#C/C(=C/c1ccc(o1)COc1ccc(cc1)[N+](=O)[O-])/C(=O)Nc1ccc2c(c1)OCO2

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Molecular Weight: 433.38
Empirical Formula: C22H15N3O7

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.679
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 139
Number of rings: 4

     

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