COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171621
Chemical Name: (16E)-3-hydroxy-16-[4-(trifluoromethoxy)benzylidene]estra-1(10),2,4-trien-17-one
Smiles: Oc1ccc2c(c1)CCC1C2CCC2(C1C/C(=C\c1ccc(cc1)OC(F)(F)F)/C2=O)C

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Molecular Weight: 442.48
Empirical Formula: C26H25F3O3

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 7.012
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 46
Number of rings: 5

     

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