COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564638
Chemical Name: (5alpha,17beta,25xi)-20-hydroxy-3-methylcevan-6-one
Smiles: CC1CC[C@]2([C@H](C1)C(=O)C[C@@H]1[C@@H]2C[C@@H]2[C@H]1CC[C@@H]1[C@H]2CN2CC(C)CC[C@H]2[C@@]1(C)O)C

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Molecular Weight: 427.67
Empirical Formula: C28H45NO2

Physical State: Liquid
Available Amount: 273 mg

Lipinsky:
logP: 6.064
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 40
Number of rings: 6

     

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