Glycoside
GD077944
Name:
NoneFormula:
C19H22O4N6Smiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)n(/C=C/c3ccccc3)c(=N)nc21Aglycone:
N=c1nc2c(c(N)n1C=Cc1ccccc1)N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 398.42 | Num_heavy_atoms: | 29 |
| TPSA: | 144.43 | NumAromaticRings: | 3 |
Unique Aglycone
AD35717
Formula: C13H11N6
Smiles:
N=c1nc2c(c(N)n1C=Cc1ccccc1)N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 251.27 | Num_heavy_atoms: | 19 |
| TPSA: | 94.15 | NumAromaticRings: | 2 |
