64158-84-5
Product Name:
3-MERCAPTO-3-METHYL-BUTYRYL-TYR-PHE-VAL-ASN-CYS-PRO-D-ARG-GLY-NH2
Formula:
C48H69N13O11S2
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COMPUTED DESCRIPTORS
Molecular Weight | 1068.3 g/mol |
---|---|
XLogP3 | -1.3 |
Hydrogen Bond Donor Count | 12 |
Hydrogen Bond Acceptor Count | 14 |
Rotatable Bond Count | 17 |
Exact Mass | 1067.46809242 g/mol |
Monoisotopic Mass | 1067.46809242 g/mol |
Topological Polar Surface Area | 445 Ų |
Heavy Atom Count | 74 |
Formal Charge | 0 |
Complexity | 2030 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 7 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |