COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326067
Chemical Name: (2E)-3-formyl-4-oxopent-2-en-2-olate
Smiles: O=C/C(=C(/C)\[O-])/C(=O)C

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Saltdata: 1/2Ni2+
Molecular Weight: 127.12
Empirical Formula: C6H7O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.258
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 57
Number of rings: 0

     

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