Bortezomib

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 1406
Total Number of Articles : 2135
PubChem 387447
Molecular Formula

C19H25BN4O4

SMILES

B([C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=NC=CN=C2)(O)O

InChI

InChI=1S/C19H25BN4O4/c1-13(2)10-17(20(27)28)24-18(25)15(11-14-6-4-3-5-7-14)23-19(26)16-12-21-8-9-22-16/h3-9,12-13,15,17,27-28H,10-11H2,1-2H3,(H,23,26)(H,24,25)/t15-,17-/m0/s1

synonyms
  • Bortezomib
  • 179324-69-7
  • Velcade
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Properties
Property Value
MW 384.2 g/mol
HBD 4
HBA 6
Rotatable Bond Count 9
Exact Mass 384.1968855 g/mol
Monoisotopic Mass 384.1968855 g/mol
Heavy Atom Count 28
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 500
xlogp None
Topological Polar Surface Area 124