COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK009041
Chemical Name: (2E)-2-cyano-N-(4-methyl-2-nitrophenyl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(OC)c(c(c1)OC)OC)/C(=O)Nc1ccc(cc1[N+](=O)[O-])C

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Molecular Weight: 397.39
Empirical Formula: C20H19N3O6

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 3.685
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 2

     

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