COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK949521
Chemical Name: (2Z)-2-(3,4-dimethoxyphenyl)-3-[5-(4-nitrophenyl)thiophen-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccc(s1)c1ccc(cc1)[N+](=O)[O-])/c1ccc(c(c1)OC)OC

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Molecular Weight: 392.44
Empirical Formula: C21H16N2O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.627
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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