COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473098
Chemical Name: (2E)-N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-3-{3-methoxy-2-[(3-methylbenzyl)oxy]phenyl}prop-2-enamide
Smiles: N#C/C(=C\c1cccc(c1OCc1cccc(c1)C)OC)/C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 456.5
Empirical Formula: C27H24N2O5

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 4.962
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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