COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525797
Chemical Name: methyl(2S,4aS,6aS,6bR,13aS)-2,4a,6a,6b,9,9,13a-heptamethyl-14-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,13,13a,13b,14,15b-octadecahydropiceno[2,3-d][1,2]oxazole-2-carboxylate
Smiles: COC(=O)[C@@]1(C)CC[C@]2(C(C1)C1=CC(=O)C3[C@@]([C@@]1(CC2)C)(C)CCC1[C@]3(C)Cc2cnoc2C1(C)C)C

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Molecular Weight: 507.71
Empirical Formula: C32H45NO4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.589
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 69
Number of rings: 6

     

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