Glycoside
GD014656
Name:
NoneFormula:
C18H21O5N5Smiles:
Cc1cccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1OAglycone:
Cc1cccc(CNc2ncnc3c2N=C[N]3)c1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 387.4 | Num_heavy_atoms: | 28 |
| TPSA: | 145.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD10755
Formula: C13H12ON5
Smiles:
Cc1cccc(CNc2ncnc3c2N=C[N]3)c1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 2.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 254.27 | Num_heavy_atoms: | 19 |
| TPSA: | 84.5 | NumAromaticRings: | 2 |
