COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522828
Chemical Name: methyl2-{[(2E)-2-cyano-3-(3-methoxy-4-{[(4-methylphenyl)carbonyl]oxy}phenyl)prop-2-enoyl]amino}benzoate
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OC(=O)c1ccc(cc1)C)/C(=O)Nc1ccccc1C(=O)OC

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Molecular Weight: 470.48
Empirical Formula: C27H22N2O6

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 6.302
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 114
Number of rings: 3

     

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