COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL249060
Chemical Name: 4-{[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]carbonyl}-2-(3-methylbutyl)isoquinolin-1(2H)-one
Smiles: CC(CCn1cc(C(=O)N2CCC(CC2)(O)c2ccc(cc2)Cl)c2c(c1=O)cccc2)C

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Molecular Weight: 452.98
Empirical Formula: C26H29ClN2O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.528
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 60
Number of rings: 4

     

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