COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK700047
Chemical Name: (2E,4E)-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-5-(2-nitrophenyl)penta-2,4-dienenitrile
Smiles: N#C/C(=C\C=C\c1ccccc1[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)OC)OC

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Molecular Weight: 419.46
Empirical Formula: C22H17N3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.284
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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