COMPUTED DESCRIPTORS
Molecular Weight | 333.4 g/mol |
---|---|
XLogP3 | 2.8 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 333.147726857 g/mol |
Monoisotopic Mass | 333.147726857 g/mol |
Topological Polar Surface Area | 74 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 503 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-benzyl-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione is a natural product found in Aspergillus niger with data available.