Glycoside
GD028043
Name:
NoneFormula:
C22H35O4N5Smiles:
OC[C@@H]1OC(n2cnc3c(NC4CCCCCCCCCCC4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NC2CCCCCCCCCCC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.77 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 433.55 | Num_heavy_atoms: | 31 |
| TPSA: | 125.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD18357
Formula: C17H26N5
Smiles:
C1=Nc2c(ncnc2NC2CCCCCCCCCCC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.71 |
| AlogP: | 4.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.43 | Num_heavy_atoms: | 22 |
| TPSA: | 64.27 | NumAromaticRings: | 1 |
