COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL470849
Chemical Name: 24-(3,4-dihydroisoquinolin-2(1H)-yl)-3,7-dihydroxycholan-24-one
Smiles: OC1CCC2(C(C1)CC(C1C2CCC2(C1CCC2C(CCC(=O)N1CCc2c(C1)cccc2)C)C)O)C

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Molecular Weight: 507.76
Empirical Formula: C33H49NO3

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 6.56
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 60
Number of rings: 6

     

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