COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473617
Chemical Name: 4-{(1E)-3-[(1,3-benzodioxol-5-ylmethyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}-2-methoxyphenyl2-chlorobenzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccccc1Cl)/C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 490.9
Empirical Formula: C26H19ClN2O6

Physical State: Dry powder
Available Amount: 75 mg

Lipinsky:
logP: 4.492
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 106
Number of rings: 4

     

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