Glycoside
GD022049
Name:
NoneFormula:
C19H21O4N5Smiles:
OC[C@@H]1OC(n2cnc3c2N=CN2C[C@H](Cc4ccccc4)N=C32)[C@H](O)[C@H]1OAglycone:
C1=NC2=C(N=C[N]2)C2=NC(Cc3ccccc3)CN12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.42 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 383.41 | Num_heavy_atoms: | 28 |
| TPSA: | 115.7 | NumAromaticRings: | 2 |
Unique Aglycone
AD14992
Formula: C14H12N5
Smiles:
C1=NC2=C(N=C[N]2)C2=NC(Cc3ccccc3)CN12| HBA: | 5 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.21 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 250.28 | Num_heavy_atoms: | 19 |
| TPSA: | 54.42 | NumAromaticRings: | 1 |
