Glycoside
GD004401
Name:
NoneFormula:
C16H23O4N5Smiles:
C[C@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cnc2c(NC3CCCC3)ncnc21Aglycone:
C1=Nc2c(ncnc2NC2CCCC2)[N]1Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.69 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 349.39 | Num_heavy_atoms: | 25 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD00959
Formula: C10H12N5
Smiles:
C1=Nc2c(ncnc2NC2CCCC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 202.24 | Num_heavy_atoms: | 15 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
