Glycoside
GD003468
Name:
NoneFormula:
C19H21O4N7Smiles:
OC[C@@H]1OC(n2cnc3c(NCCc4nc5ccccc5[nH]4)ncnc32)[C@H](O)[C@H]1OAglycone:
C1=Nc2c(ncnc2NCCc2nc3ccccc3[nH]2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 411.42 | Num_heavy_atoms: | 30 |
| TPSA: | 154.23 | NumAromaticRings: | 4 |
Unique Aglycone
AD03157
Formula: C14H12N7
Smiles:
C1=Nc2c(ncnc2NCCc2nc3ccccc3[nH]2)[N]1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 278.3 | Num_heavy_atoms: | 21 |
| TPSA: | 92.95 | NumAromaticRings: | 3 |
