Glycoside
GD101283
Name:
NoneFormula:
C15H17O4N6ISmiles:
Cn1cc(Nc2ncnc3c2c(I)cn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1Aglycone:
Cn1cc(Nc2ncnc3c2C(I)=C[N]3)cn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 472.24 | Num_heavy_atoms: | 26 |
| TPSA: | 130.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD42851
Formula: C10H8N6I
Smiles:
Cn1cc(Nc2ncnc3c2C(I)=C[N]3)cn1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 339.12 | Num_heavy_atoms: | 17 |
| TPSA: | 69.73 | NumAromaticRings: | 2 |
