COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK330876
Chemical Name: (5Z)-2-[(3-bromophenyl)amino]-5-[4-(2,4-dinitrophenoxy)benzylidene]-1,3-thiazol-4(5H)-one
Smiles: Brc1cccc(c1)NC1=NC(=O)/C(=C/c2ccc(cc2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/S1

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Molecular Weight: 541.34
Empirical Formula: C22H13BrN4O6S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.31
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 167
Number of rings: 4

     

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