COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL154886
Chemical Name: 2-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-4-[(3-hydroxyphenyl)amino]-4-oxobutanoicacid
Smiles: O=C(CC(C(=O)O)CN1CCc2c(C1)cccc2)Nc1cccc(c1)O

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Molecular Weight: 354.41
Empirical Formula: C20H22N2O4

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 3.1
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 89
Number of rings: 3

     

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