Glycoside
GD001338
Name:
NoneFormula:
C20H23O5N5Smiles:
CC[C@H](Cc1ccccc1)Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H]1OAglycone:
CCC(Cc1ccccc1)Nc1ncnc2c1N=C[N]2Sugarmoiety:
O=C(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 413.43 | Num_heavy_atoms: | 30 |
| TPSA: | 142.62 | NumAromaticRings: | 3 |
Unique Aglycone
AD01365
Formula: C15H16N5
Smiles:
CCC(Cc1ccccc1)Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 2.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 266.33 | Num_heavy_atoms: | 20 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
