COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902239
Chemical Name: (2E)-1-(1,3-benzodioxol-5-yl)-3-{[3-(pyrrolidin-1-ylmethyl)phenyl]amino}prop-2-en-1-one
Smiles: O=C(c1ccc2c(c1)OCO2)/C=C/Nc1cccc(c1)CN1CCCC1

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Molecular Weight: 350.42
Empirical Formula: C21H22N2O3

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 2.297
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 50
Number of rings: 4

     

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