COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL023101
Chemical Name: (2E)-3-(5-nitrothiophen-2-yl)prop-2-enoicacid
Smiles: OC(=O)/C=C/c1ccc(s1)[N+](=O)[O-]

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Molecular Weight: 199.19
Empirical Formula: C7H5NO4S

Physical State: Dry powder
Available Amount: 1549 mg

Lipinsky:
logP: 2.148
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 111
Number of rings: 1

     

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