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7619-53-6

7619-53-6 structural image
Product Name: clomifene citrate
Formula: C32H36ClNO8
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 205.5 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

COMPUTED DESCRIPTORS

Molecular Weight 598.1 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 14
Exact Mass 597.2129448 g/mol
Monoisotopic Mass 597.2129448 g/mol
Topological Polar Surface Area 145 Ų
Heavy Atom Count 42
Formal Charge 0
Complexity 708
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Zuclomiphene Citrate is the cis isomer of clomiphene which exhibits weak estrogen agonist activity evaluated for antineoplastic activity against breast cancer. (NCI04)