Glycoside
GD080918
Name:
NoneFormula:
C18H24O5N6Smiles:
O=C1CN(c2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[C@H]2CCCC[C@H]2N1Aglycone:
O=C1CN(c2ncnc3c2N=C[N]3)C2CCCCC2N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 404.43 | Num_heavy_atoms: | 29 |
| TPSA: | 145.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD36530
Formula: C13H15ON6
Smiles:
O=C1CN(c2ncnc3c2N=C[N]3)C2CCCCC2N1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.54 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 1 |
| MolWt: | 271.3 | Num_heavy_atoms: | 20 |
| TPSA: | 84.58 | NumAromaticRings: | 1 |
