COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK149237
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-[1-(4-methoxyphenyl)-2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethyl]-N-methylprop-2-enamide
Smiles: COc1ccc(cc1)C(N(C(=O)/C=C/c1ccc2c(c1)OCO2)C)C(=O)Nc1ccc(cc1)C(C)C

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Molecular Weight: 486.57
Empirical Formula: C29H30N2O5

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 5.652
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 77
Number of rings: 4

     

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