COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL318583
Chemical Name: methylN-{[2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinolin]-4'-yl]carbonyl}-beta-alaninate
Smiles: COCCN1C(=O)c2ccccc2C(C21CCCC2)C(=O)NCCC(=O)OC

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Molecular Weight: 388.46
Empirical Formula: C21H28N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.788
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 84
Number of rings: 3

     

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