COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK998562
Chemical Name: 3-methylbutyl(2Z)-3-(1,3-benzodioxol-5-yl)-2-{[(2-methoxyphenyl)carbonyl]amino}prop-2-enoate
Smiles: COc1ccccc1C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)OCCC(C)C

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Molecular Weight: 411.45
Empirical Formula: C23H25NO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.232
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 83
Number of rings: 3

     

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