Glycoside
GD085731
Name:
NoneFormula:
C20H22O4N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCCc4c[nH]c5ccccc45)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2NCCc2c[nH]c3ccccc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 6 |
| MolWt: | 410.43 | Num_heavy_atoms: | 30 |
| TPSA: | 141.34 | NumAromaticRings: | 4 |
Unique Aglycone
AD18249
Formula: C15H13N6
Smiles:
C1=Nc2c(ncnc2NCCc2c[nH]c3ccccc23)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 277.31 | Num_heavy_atoms: | 21 |
| TPSA: | 80.06 | NumAromaticRings: | 3 |
