Glycoside
GD082379
Name:
NoneFormula:
C18H26O5N6Smiles:
CC(C)C[C@H]1C(=O)NCCN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC(C)CC1C(=O)NCCN1c1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.44 | Num_heavy_atoms: | 29 |
| TPSA: | 145.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD37017
Formula: C13H17ON6
Smiles:
CC(C)CC1C(=O)NCCN1c1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 273.32 | Num_heavy_atoms: | 20 |
| TPSA: | 84.58 | NumAromaticRings: | 1 |
