COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL464912
Chemical Name: methyl4-({[(8xi,9xi,14xi,17alpha)-17-(pentanoyloxy)estra-1,3,5(10)-trien-3-yl]oxy}methyl)benzoate
Smiles: CCCCC(=O)O[C@@H]1CCC2[C@]1(C)CCC1C2CCc2c1ccc(c2)OCc1ccc(cc1)C(=O)OC

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Molecular Weight: 504.67
Empirical Formula: C32H40O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 8.905
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 61
Number of rings: 5

     

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