Glycoside
GD069042
Name:
NoneFormula:
C15H19O4N5SSmiles:
OC[C@H]1O[C@@H](n2cnc3c(N=C4CCSCC4)ncnc32)[C@@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N=C2CCSCC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.6 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 365.42 | Num_heavy_atoms: | 25 |
| TPSA: | 125.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD32724
Formula: C10H10N5S
Smiles:
C1=Nc2c(ncnc2N=C2CCSCC2)[N]1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.4 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 232.29 | Num_heavy_atoms: | 16 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
