COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509480
Chemical Name: (3Z)-3-[2-(5-bromothiophen-2-yl)-2-oxoethylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
Smiles: Brc1ccc(s1)C(=O)/C=C/1\C(=O)Nc2c1cc(cc2)[N+](=O)[O-]

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Molecular Weight: 379.19
Empirical Formula: C14H7BrN2O4S

Physical State: Dry powder
Available Amount: 91 mg

Lipinsky:
logP: 4.335
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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