COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL327035
Chemical Name: (2E,4E)-3-methyl-4-(naphthalen-2-ylmethylidene)pent-2-enedioate
Smiles: [O-]C(=O)/C=C(/C(=C\c1ccc2c(c1)cccc2)/C(=O)[O-])\C

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Saltdata: 2Na+
Molecular Weight: 280.28
Empirical Formula: C17H12O4

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 3.731
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 80
Number of rings: 2

     

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