COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904847
Chemical Name: (5Z)-5-{[3-(4-methoxy-3-nitrophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: COc1ccc(cc1[N+](=O)[O-])c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccccc1)c1ccccc1

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Molecular Weight: 548.58
Empirical Formula: C29H20N6O4S

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 6.881
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 145
Number of rings: 6

     

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