COMPOUNDS FOR BIOLOGICAL SCREENING
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Vitas-M Lab ID: STL538223
Chemical Name: (3alpha,5beta,7alpha,8xi,12alpha)-3,7,12-trihydroxy-N-[2-(1H-indol-3-yl)ethyl]cholan-24-amide
Smiles: O[C@@H]1CC[C@]2([C@@H](C1)C[C@H]([C@@H]1[C@@H]2C[C@H](O)[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)NCCc1c[nH]c2c1cccc2)C)C)O)C

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Molecular Weight: 550.78
Empirical Formula: C34H50N2O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.947
Rotatable bonds: 7
H-donors: 5
H-acceptors: 4
PSA: 105
Number of rings: 6

     

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