COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK987021
Chemical Name: (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-[4-(propan-2-yl)phenyl]prop-2-en-1-one
Smiles: CC(c1ccc(cc1)C(=O)/C=C/Nc1ccc2c(c1)OCCO2)C

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Molecular Weight: 323.39
Empirical Formula: C20H21NO3

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 4.296
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 3

     

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