COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382013
Chemical Name: methyl(2Z)-3-(1,3-benzodioxol-5-yl)-2-{[(5-bromofuran-2-yl)carbonyl]amino}prop-2-enoate
Smiles: COC(=O)/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccc(o1)Br

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Molecular Weight: 394.18
Empirical Formula: C16H12BrNO6

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 2.495
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 87
Number of rings: 3

     

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