COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL470834
Chemical Name: ethyl4-(3,7-dihydroxy-24-oxocholan-24-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)CCC(C1CCC2C1(C)CCC1C2C(O)CC2C1(C)CCC(C2)O)C

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Molecular Weight: 532.76
Empirical Formula: C31H52N2O5

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 5.652
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 90
Number of rings: 5

     

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