CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 526.7 Ų [M+3H]3+ 434.9 Ų [M+2H]2+ |
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COMPUTED DESCRIPTORS
Molecular Weight | 1672.9 g/mol |
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XLogP3 | -3.7 |
Hydrogen Bond Donor Count | 21 |
Hydrogen Bond Acceptor Count | 23 |
Rotatable Bond Count | 50 |
Exact Mass | 1671.90967533 g/mol |
Monoisotopic Mass | 1671.90967533 g/mol |
Topological Polar Surface Area | 674 Ų |
Heavy Atom Count | 119 |
Formal Charge | 0 |
Complexity | 3530 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 14 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Neurotensin is a 13 amino acid peptide hormone which is found in the central nervous system and the gastrointestinal tract. It behaves as a neurotransmitter in the brain, as a hormone in the gut, and also as a neuromodulator. It is implicated in the pathophysiology of several CNS disorders (including schizophrenia, Parkinson's disease, drug abuse, pain, cancer, inflammation, eating disorders and central control of blood pressure) due to its association with a wide variety of neurotransmitter systems such as dopaminergic, sertonergic, glutamatergic, GABAergic, and cholinergic systems. It has a role as a human metabolite, a mitogen, a neurotransmitter and a vulnerary. It is a conjugate base of a neurotensin(1+).