Glycoside
GD091041
Name:
NoneFormula:
C20H28O4N8Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCCCc4nnc5n4CCCCC5)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCCCc2nnc3n2CCCCC3)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 7 |
| MolWt: | 444.5 | Num_heavy_atoms: | 32 |
| TPSA: | 156.26 | NumAromaticRings: | 3 |
Unique Aglycone
AD39667
Formula: C15H19N8
Smiles:
C1=Nc2c(ncnc2NCCCc2nnc3n2CCCCC3)[N]1| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.53 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 5 |
| MolWt: | 311.37 | Num_heavy_atoms: | 23 |
| TPSA: | 94.98 | NumAromaticRings: | 2 |
