COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319418
Chemical Name: methylN-{[2'-(2-methylpropyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinolin]-4'-yl]carbonyl}-beta-alaninate
Smiles: COC(=O)CCNC(=O)C1c2ccccc2C(=O)N(C21CCCCC2)CC(C)C

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Molecular Weight: 400.52
Empirical Formula: C23H32N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.753
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 75
Number of rings: 3

     

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