COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL154848
Chemical Name: 2-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-4-[(3-methoxyphenyl)amino]-4-oxobutanoicacid
Smiles: COc1cccc(c1)NC(=O)CC(C(=O)O)CN1CCc2c(C1)cccc2

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Molecular Weight: 368.43
Empirical Formula: C21H24N2O4

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 3.621
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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