Glycoside
GD002261
Name:
NoneFormula:
C18H19O5N5Smiles:
OCC1OC(n2nc(-c3ccccc3)nc2-c2cnccn2)C(O)C(O)C1OAglycone:
c1ccc(C2=N[N]C(c3cnccn3)=N2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -0.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 385.38 | Num_heavy_atoms: | 28 |
| TPSA: | 146.64 | 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 |
