COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539915
Chemical Name: (3alpha,5alpha,8xi)-17-oxoandrostan-3-yl2,2-dibromo-1-methylcyclopropanecarboxylate
Smiles: O=C1CC[C@@H]2[C@]1(C)CC[C@H]1C2CC[C@@H]2[C@]1(C)CC[C@H](C2)OC(=O)C1(C)CC1(Br)Br

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Molecular Weight: 530.34
Empirical Formula: C24H34Br2O3

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 6.226
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 43
Number of rings: 5

     

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