96735-00-1
Product Name:
3-(2-AMINO-ETHYL)-5-NITRO-1 H-INDOLE-2-CARBOXYLIC ACID
Formula:
C11H11N3O4
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 35.4 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 249.22 g/mol |
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XLogP3 | -1.2 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 3 |
Exact Mass | 249.07495584 g/mol |
Monoisotopic Mass | 249.07495584 g/mol |
Topological Polar Surface Area | 125 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 344 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |