Glycoside
GD070631
Name:
NoneFormula:
C17H15O5N5Smiles:
N#Cc1ccc(Oc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
N#Cc1ccc(Oc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 369.34 | Num_heavy_atoms: | 27 |
| TPSA: | 146.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD33459
Formula: C12H6ON5
Smiles:
N#Cc1ccc(Oc2ncnc3c2N=C[N]3)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 236.21 | Num_heavy_atoms: | 18 |
| TPSA: | 85.26 | NumAromaticRings: | 2 |
