COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK900063
Chemical Name: (2E,4E)-2-[4-(4-chlorophenyl)-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(cc1)Cl

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Molecular Weight: 393.85
Empirical Formula: C20H12ClN3O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.367
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 110
Number of rings: 3

     

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