COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK293062
Chemical Name: (2E)-2-(1,3-benzodioxol-5-yl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])/c1ccc2c(c1)OCO2

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Molecular Weight: 394.77
Empirical Formula: C20H11ClN2O5

Physical State: Dry powder
Available Amount: 86 mg

Lipinsky:
logP: 6.205
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 101
Number of rings: 4

     

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