BI 2536

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 58
Total Number of Articles : 128
PubChem 11364421
Molecular Formula

C28H39N7O3

SMILES

CC[C@@H]1C(=O)N(C2=CN=C(N=C2N1C3CCCC3)NC4=C(C=C(C=C4)C(=O)NC5CCN(CC5)C)OC)C

InChI

InChI=1S/C28H39N7O3/c1-5-22-27(37)34(3)23-17-29-28(32-25(23)35(22)20-8-6-7-9-20)31-21-11-10-18(16-24(21)38-4)26(36)30-19-12-14-33(2)15-13-19/h10-11,16-17,19-20,22H,5-9,12-15H2,1-4H3,(H,30,36)(H,29,31,32)/t22-/m1/s1

synonyms
  • BI 2536
  • 755038-02-9
  • BI-2536
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Properties
Property Value
MW 521.7 g/mol
HBD 2
HBA 8
Rotatable Bond Count 7
Exact Mass 521.31143813 g/mol
Monoisotopic Mass 521.31143813 g/mol
Heavy Atom Count 38
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 816
xlogp 3.7
Topological Polar Surface Area 103