COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902497
Chemical Name: (2E)-1-(3,4-dimethoxyphenyl)-3-{[3-(pyrrolidin-1-ylmethyl)phenyl]amino}prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/Nc1cccc(c1)CN1CCCC1

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Molecular Weight: 366.46
Empirical Formula: C22H26N2O3

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.124
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 50
Number of rings: 3

     

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