Glycoside
GD022980
Name:
NoneFormula:
C17H17O4N5Smiles:
OCC1OC(n2nc(-c3ccccc3)nc2-c2cnccn2)C(O)C1OAglycone:
c1ccc(C2=N[N]C(c3cnccn3)=N2)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.35 | Num_heavy_atoms: | 26 |
| TPSA: | 126.41 | NumAromaticRings: | 3 |
Unique Aglycone
AD02179
Formula: C12H8N5
Smiles:
c1ccc(C2=N[N]C(c3cnccn3)=N2)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 222.23 | Num_heavy_atoms: | 17 |
| TPSA: | 64.6 | NumAromaticRings: | 2 |
