Molecule Info: ABT-491 free base
Smiles:
CC1=NC2=C(N1CC3=C(C=C(C=C3)C(=O)C4=CN(C5=CC=CC(=C54)C#C)C(=O)N(C)C)F)C=CN=C2
InChIKey:
GDLNHSUSOZEAOR-UHFFFAOYSA-N
InChI:
InChI=1S/C28H22FN5O2/c1-5-18-7-6-8-25-26(18)21(16-34(25)28(36)32(3)4)27(35)19-9-10-20(22(29)13-19)15-33-17(2)31-23-14-30-12-11-24(23)33/h1,6-14,16H,15H2,2-4H3
InChIcol:
1
More information (from its Standard Form):
ABT-491 free base
Complex structures in which this molecule appears :
Complex Structure ID: 708
Image of the Specific State
