COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK869010
Chemical Name: (2Z)-2-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Smiles: Brc1cc(ccc1c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 428.26
Empirical Formula: C19H10BrNO4S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.105
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 101
Number of rings: 4

     

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