Glycoside
GD027113
Name:
NoneFormula:
C23H25O4N5Smiles:
C[C@H](CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O)c1cccc2ccccc12Aglycone:
CC(CNc1ncnc2c1N=C[N]2)c1cccc2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.35 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 435.48 | Num_heavy_atoms: | 32 |
| TPSA: | 125.55 | NumAromaticRings: | 4 |
Unique Aglycone
AD17847
Formula: C18H16N5
Smiles:
CC(CNc1ncnc2c1N=C[N]2)c1cccc2ccccc12| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.17 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 4 |
| MolWt: | 302.36 | Num_heavy_atoms: | 23 |
| TPSA: | 64.27 | NumAromaticRings: | 3 |
