COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK002098
Chemical Name: (2E)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-(2,4-dichlorophenyl)prop-2-en-1-one
Smiles: Clc1ccc(c(c1)Cl)/C=C/C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 419.31
Empirical Formula: C21H20Cl2N2O3

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 3.943
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 42
Number of rings: 4

     

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