COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL181157
Chemical Name: (3alpha,8xi,9xi,12alpha,14xi,17xi,20xi)-3,12-dihydroxy-N'-[(1E)-1-(6-methyl-2,4-dioxo-2H-pyran-3(4H)-ylidene)ethyl]cholane-24-hydrazide
Smiles: O[C@@H]1CC[C@]2(C(C1)CCC1C2C[C@H](O)[C@]2(C1CCC2C(CCC(=O)NN/C(=C\1/C(=O)OC(=CC1=O)C)/C)C)C)C

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Molecular Weight: 556.74
Empirical Formula: C32H48N2O6

Physical State: Dry powder
Available Amount: 42 mg

Lipinsky:
logP: 5.272
Rotatable bonds: 5
H-donors: 4
H-acceptors: 6
PSA: 124
Number of rings: 5

     

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