COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL012090
Chemical Name: (1E)-prop-1-ene-1,2,3-tricarboxylicacid
Smiles: OC(=O)C/C(=C/C(=O)O)/C(=O)O

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Molecular Weight: 174.11
Empirical Formula: C6H6O6

Physical State: Dry powder
Available Amount: 1495 mg

Lipinsky:
logP: 0.626
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 111
Number of rings: 0

     

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