Glycoside
GD060419
Name:
NoneFormula:
C15H19O4N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N=C4CCCC4)ncnc32)[C@@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N=C2CCCC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 333.35 | Num_heavy_atoms: | 24 |
| TPSA: | 125.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD29850
Formula: C10H10N5
Smiles:
C1=Nc2c(ncnc2N=C2CCCC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 200.22 | Num_heavy_atoms: | 15 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
