Glycoside
GD078528
Name:
NoneFormula:
C17H23O5N5Smiles:
O=C(Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)NC1CCCC1Aglycone:
O=C(Nc1ncnc2c1C=C[N]2)NC1CCCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 377.4 | Num_heavy_atoms: | 27 |
| TPSA: | 141.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD36072
Formula: C12H14ON5
Smiles:
O=C(Nc1ncnc2c1C=C[N]2)NC1CCCC1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.28 | Num_heavy_atoms: | 18 |
| TPSA: | 81.01 | NumAromaticRings: | 1 |
