Glycoside
GD103650
Name:
NoneFormula:
C24H26O5N6Smiles:
Nc1ccc(CCN(C(=O)C2=CC=CC2)c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
Nc1ccc(CCN(C(=O)C2=CC=CC2)c2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 7 |
| MolWt: | 478.51 | Num_heavy_atoms: | 35 |
| TPSA: | 159.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD43850
Formula: C19H17ON6
Smiles:
Nc1ccc(CCN(C(=O)C2=CC=CC2)c2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.16 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 5 |
| MolWt: | 345.39 | Num_heavy_atoms: | 26 |
| TPSA: | 98.57 | NumAromaticRings: | 2 |
