COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473625
Chemical Name: (2E)-N-(1,3-benzodioxol-5-ylmethyl)-3-{2-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1cccc(c1OCc1cccc(c1)Cl)OC)/C(=O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 476.92
Empirical Formula: C26H21ClN2O5

Physical State: Dry powder
Available Amount: 336 mg

Lipinsky:
logP: 5.097
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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