Glycoside
GD101221
Name:
NoneFormula:
C22H26O5N6Smiles:
O=C(c1cccc(Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1)N1CCCCC1Aglycone:
O=C(c1cccc(Nc2ncnc3c2N=C[N]3)c1)N1CCCCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.45 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 5 |
| MolWt: | 454.49 | Num_heavy_atoms: | 33 |
| TPSA: | 145.86 | NumAromaticRings: | 3 |
Unique Aglycone
AD42804
Formula: C17H17ON6
Smiles:
O=C(c1cccc(Nc2ncnc3c2N=C[N]3)c1)N1CCCCC1| HBA: | 7 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 2.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.36 | Num_heavy_atoms: | 24 |
| TPSA: | 84.58 | NumAromaticRings: | 2 |
