COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864143
Chemical Name: (2E)-3-(4-chloro-3-nitrophenyl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enamide
Smiles: O=C(Nc1scc(n1)c1ccc(cc1)C)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 399.86
Empirical Formula: C19H14ClN3O3S

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 5.359
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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