COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL575384
Chemical Name: [(2S,4aS,6aS,6bS,10aR)-6b-acetyl-2-hydroxy-6a-methyl-1,2,3,4,4b,5,6,6a,6b,7,8,9,10,10a,11,11a,11b,12-octadecahydro-4aH-indeno[2,1-a]phenanthren-4a-yl]methyl4-methylbenzenesulfonate
Smiles: O[C@H]1CC[C@]2(C(=CCC3C2CC[C@]2(C3C[C@@H]3[C@]2(CCCC3)C(=O)C)C)C1)COS(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 540.76
Empirical Formula: C32H44O5S

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 6.176
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 6

     

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