COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK006295
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(4-chloro-2,5-dimethoxyphenyl)prop-2-enamide
Smiles: COc1cc(Cl)c(cc1NC(=O)/C=C/c1ccc2c(c1)OCO2)OC

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Molecular Weight: 361.78
Empirical Formula: C18H16ClNO5

Physical State: Dry powder
Available Amount: 373 mg

Lipinsky:
logP: 5.233
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 66
Number of rings: 3

     

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