IB-MECA
IB-MECA
SMILES | CNC(=O)C1OC(n2cnc3c(NCc4cccc(I)c4)ncnc32)C(O)C1O |
InChIKey | HUJXGQILHAUCCV-UHFFFAOYSA-N |
Chemical Properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 4 |
Rotatable bonds | 5 |
Molecular weight (Da) | 510.1 |
SMILES | CNC(=O)C1OC(n2cnc3c(NCc4cccc(I)c4)ncnc32)C(O)C1O |
InChIKey | HUJXGQILHAUCCV-UHFFFAOYSA-N |
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 4 |
Rotatable bonds | 5 |
Molecular weight (Da) | 510.1 |