COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552705
Chemical Name: (2Z,4E)-4-(furan-2-ylmethylidene)-2-methylpent-2-enedioate
Smiles: [O-]C(=O)/C(=C/c1ccco1)/C=C(\C(=O)[O-])/C

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Saltdata: 2Na+
Molecular Weight: 220.18
Empirical Formula: C11H8O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.122
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 93
Number of rings: 1

     

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