Glycoside
GD024380
Name:
NoneFormula:
C21H26O3N4Smiles:
CC(C)CNc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](C)[C@H](O)[C@H]1OAglycone:
CC(C)CNc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 2.81 | Num_rotatable_bonds: | 5 |
| MolWt: | 382.46 | Num_heavy_atoms: | 28 |
| TPSA: | 92.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD16280
Formula: C16H17N4
Smiles:
CC(C)CNc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 3.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 265.34 | Num_heavy_atoms: | 20 |
| TPSA: | 51.91 | NumAromaticRings: | 2 |
