COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL433133
Chemical Name: (3Z)-4-(7-methoxy-1,3-benzodioxol-5-yl)-3-(methoxycarbonyl)but-3-enoicacid
Smiles: COC(=O)/C(=C\c1cc(OC)c2c(c1)OCO2)/CC(=O)O

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Molecular Weight: 294.26
Empirical Formula: C14H14O7

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 2.877
Rotatable bonds: 7
H-donors: 1
H-acceptors: 7
PSA: 91
Number of rings: 2

     

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