Glycoside
GD091919
Name:
NoneFormula:
C20H23O5N7Smiles:
O=C1[C@@H](Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CCCN1c1cccnc1Aglycone:
O=C1C(Nc2ncnc3c2N=C[N]3)CCCN1c1cccnc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | -0.56 | Num_rotatable_bonds: | 5 |
| MolWt: | 441.45 | Num_heavy_atoms: | 32 |
| TPSA: | 158.75 | NumAromaticRings: | 3 |
Unique Aglycone
AD40104
Formula: C15H14ON7
Smiles:
O=C1C(Nc2ncnc3c2N=C[N]3)CCCN1c1cccnc1| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.32 | Num_heavy_atoms: | 23 |
| TPSA: | 97.47 | NumAromaticRings: | 2 |
