Glycoside
GD001733
Name:
NoneFormula:
C19H24O4N6Smiles:
C[C@]1(O)[C@H](O)[C@H](CO)O[C@H]1n1cnc2c(NCCc3ccccc3)nc(N)nc21Aglycone:
Nc1nc2c(c(NCCc3ccccc3)n1)N=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 6 |
| MolWt: | 400.44 | Num_heavy_atoms: | 29 |
| TPSA: | 151.57 | NumAromaticRings: | 3 |
Unique Aglycone
AD01706
Formula: C13H13N6
Smiles:
Nc1nc2c(c(NCCc3ccccc3)n1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 253.29 | Num_heavy_atoms: | 19 |
| TPSA: | 90.29 | NumAromaticRings: | 2 |
