Glycoside
GD084474
Name:
NoneFormula:
C20H24O6N4Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccn(-c3ccc4ccccn34)n2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccn(-c2ccc3ccccn23)n1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 416.43 | Num_heavy_atoms: | 30 |
| TPSA: | 130.48 | NumAromaticRings: | 3 |
Unique Aglycone
AD37728
Formula: C14H14O2N4
Smiles:
O=C(NCCO)c1ccn(-c2ccc3ccccn23)n1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 270.29 | Num_heavy_atoms: | 20 |
| TPSA: | 71.56 | NumAromaticRings: | 3 |
