COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898611
Chemical Name: (2E)-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-enenitrile
Smiles: CCc1ccc(cc1)c1csc(n1)/C(=C/c1cc(OC)c(c(c1)[N+](=O)[O-])O)/C#N

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Molecular Weight: 407.45
Empirical Formula: C21H17N3O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.373
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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