Compound Selection

Formula: C18H22O2

MW: 270.37

 

 

TNP NUMBER: TNP00429

MDL NUMBER: MFCD00066713

IUPAC: 5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]heptadeca-2(7),3,5-trien-1 4-one

Smiles: c12C3CCC4(C(C3CCc1cc(cc2)O)CCC4=O)C

 

Estrone 99+%. Occurs in urine of pregnancy women and mares

THERAPEUTIC CATEGORY: Estrogen

 

 

 

 

ACCEPTORS: 2

DONORS: 1

ROTATION BONDS: 1

N+O: 2

Chiral Centers: 4

LogP: 5.08

LogS: -4.7

LIPINSKI: 4

 

 

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MyriaScreen II – diversity screening library from Sigma-Aldrich and TimTec
ApexScreen is a collection of 5,040 compounds that were selected to represent the diversity of TimTec stock
Chemistry reagents, HPLC columns, natural compounds
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