COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564855
Chemical Name: (1R,3aS,5aR,5bR,11aR,13aR,13bR)-5a,5b,8,8,11a-pentamethyl-9-oxo-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysene-3a-carboxylicacid
Smiles: CC(=C)[C@@H]1CC[C@]2(C1[C@H]1CCC3[C@@]([C@]1(C)CC2)(C)CCC1[C@]3(C)CCC(=O)C1(C)C)C(=O)O

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Molecular Weight: 454.69
Empirical Formula: C30H46O3

Available Amount: 0 mg

Lipinsky:
logP: 8.364
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 54
Number of rings: 5

     

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